Fluorene

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Gas phase thermochemistry data

Go To: Top, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
GT - Glushko Thermocenter, Russian Academy of Sciences, Moscow

Quantity Value Units Method Reference Comment
Δfgas176.7 ± 3.1kJ/molReviewRoux, Temprado, et al., 2008There are sufficient literature values to make a qualified recommendation where the suggested value is in good agreement with values predicted using thermochemical cycles or from reliable estimates. In general, the evaluated uncertainty limits are on the order of (2 to 4) kJ/mol.; DRB
Δfgas175.0 ± 1.5kJ/molCcrRakus, Verevkin, et al., 1994ALS
Δfgas166.9 ± 4.1kJ/molCcbSabbah, 1991see Sabbah and Antipine, 1987; ALS

Constant pressure heat capacity of gas

Cp,gas (J/mol*K) Temperature (K) Reference Comment
39.6550.Dorofeeva O.V., 1989Recommended values are also reproduced in the reference book [ Frenkel M., 1994]. These statistically calculated S(T) values agree with experimental ones within 1 J/mol*K.; GT
57.90100.
81.47150.
109.90200.
156.72273.15
173.1 ± 1.0298.15
174.31300.
236.02400.
287.48500.
328.52600.
361.28700.
387.83800.
409.68900.
427.891000.
443.211100.
456.171200.
467.221300.
476.681400.
484.831500.

Phase change data

Go To: Top, Gas phase thermochemistry data, Reaction thermochemistry data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Tboil571.2KN/AAldrich Chemical Company Inc., 1990BS
Tboil567.2KN/AWeast and Grasselli, 1989BS
Tboil569.55KN/ALecat, 1943Uncertainty assigned by TRC = 0.5 K; TRC
Quantity Value Units Method Reference Comment
Tfus388. ± 2.KAVGN/AAverage of 13 values; Individual data points
Quantity Value Units Method Reference Comment
Ttriple355.51KN/ASabbah, 1991Uncertainty assigned by TRC = 0.03 K; TRC
Ttriple387.94KN/AFinke, Messerly, et al., 1977Crystal phase 1 phase; Uncertainty assigned by TRC = 0.02 K; C2 - C1 is a second order transition; TRC
Ttriple387.94KN/AOsborn and Douslin, 1975Uncertainty assigned by TRC = 0.02 K; TRC
Quantity Value Units Method Reference Comment
Δvap72.4 ± 1.7kJ/molCGCHanshaw, Nutt, et al., 2008AC
Δvap74.4 ± 1.2kJ/molGCHaftka, Parsons, et al., 2006Based on data from 373. to 423. K.; AC
Δvap72.3kJ/molCGCChickos, Hesse, et al., 1998AC
Δvap72.2kJ/molCGCChickos, Hosseini, et al., 1995Based on data from 403. to 453. K.; AC
Δvap65.7kJ/molBRakus, Verevkin, et al., 1994Based on data from 323. to 363. K.; AC
Quantity Value Units Method Reference Comment
Δsub84. ± 5.kJ/molAVGN/AAverage of 9 values; Individual data points

Enthalpy of vaporization

ΔvapH (kJ/mol) Temperature (K) Method Reference Comment
66.9398.GCLei, Chankalal, et al., 2002Based on data from 323. to 473. K.; AC
63.3398.N/ASasse, Jose, et al., 1988Based on data from 383. to 427. K.; AC
54.2417.AStephenson and Malanowski, 1987Based on data from 402. to 568. K.; AC
56.6498.IMortimer and Murphy, 1923Based on data from 423. to 573. K.; AC

Antoine Equation Parameters

log10(P) = A − (B / (T + C))
    P = vapor pressure (bar)
    T = temperature (K)

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Temperature (K) A B C Reference Comment
434. to 573.65.251033011.0763.857Mortimer and Murphy, 1923Coefficents calculated by NIST from author's data.

Enthalpy of sublimation

ΔsubH (kJ/mol) Temperature (K) Method Reference Comment
84.9383.GSNass, Lenoir, et al., 1995Based on data from 313. to 453. K.; AC
84.9 ± 0.4343.GSRakus, Verevkin, et al., 1994Based on data from 323. to 363. K.; AC
87.0 ± 1.0318.PGSasse, Jose, et al., 1988Based on data from 318. to 333. K.; AC
78.9363.AStephenson and Malanowski, 1987Based on data from 348. to 388. K.; AC
92.2320.THansen and Eckert, 1986Based on data from 298. to 343. K.; AC
83.2328.GSSATO, INOMATA, et al., 1986Based on data from 308. to 347. K.; AC
88.4 ± 0.6303.GSSonnefeld, Zoller, et al., 1983Based on data from 283. to 323. K.; AC
83.1 ± 1.3350. to 388.N/AFinke, Messerly, et al., 1977, 2See also Osborn and Douslin, 1975, 2.; AC
81.8388.BOsborn and Douslin, 1975, 2AC
80.3 ± 0.8293.TEBudurov, 1960Based on data from 286. to 300. K.; AC
82.8306. to 322.N/ABradley and Cleasby, 1953See also Jones, 1960.; AC
82.8315.N/ABradley and Cleasby, 1953, 2Based on data from 306. to 323. K. See also Stephenson and Malanowski, 1987.; AC
82.843306.30VBradley and Cleasby, 1953, 3ALS

Enthalpy of fusion

ΔfusH (kJ/mol) Temperature (K) Method Reference Comment
19.1387.7DSCLisicki and Jamróz, 2000AC
19.58387.9N/ADomalski and Hearing, 1996AC
19.870387.0N/AEibert, 1944DH

Entropy of fusion

ΔfusS (J/mol*K) Temperature (K) Reference Comment
51.3387.0Eibert, 1944DH

Temperature of phase transition

Ttrs (K) Initial Phase Final Phase Reference Comment
288.crystaline, IIcrystaline, IFinke, Messerly, et al., 1977, 2Second order transition.; DH

Enthalpy of phase transition

ΔHtrs (kJ/mol) Temperature (K) Initial Phase Final Phase Reference Comment
19.5782387.94crystaline, IliquidFinke, Messerly, et al., 1977, 2DH

Entropy of phase transition

ΔStrs (J/mol*K) Temperature (K) Initial Phase Final Phase Reference Comment
50.47387.94crystaline, IliquidFinke, Messerly, et al., 1977, 2DH

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:


Reaction thermochemistry data

Go To: Top, Gas phase thermochemistry data, Phase change data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
B - John E. Bartmess
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

C13H9- + Hydrogen cation = Fluorene

By formula: C13H9- + H+ = C13H10

Quantity Value Units Method Reference Comment
Δr1466. ± 8.4kJ/molD-EARömer, Janaway, et al., 1997gas phase; B
Δr1472. ± 8.8kJ/molG+TSTaft and Bordwell, 1988gas phase; B
Δr1478. ± 11.kJ/molG+TSCumming and Kebarle, 1978gas phase; B
Quantity Value Units Method Reference Comment
Δr1434. ± 8.8kJ/molH-TSRömer, Janaway, et al., 1997gas phase; B
Δr1439. ± 8.4kJ/molIMRETaft and Bordwell, 1988gas phase; B
Δr1446. ± 8.4kJ/molIMRECumming and Kebarle, 1978gas phase; B

C10H8+ + Fluorene = (C10H8+ • Fluorene)

By formula: C10H8+ + C13H10 = (C10H8+ • C13H10)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr61.1kJ/molPHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr120.J/mol*KN/AMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M

Free energy of reaction

ΔrG° (kJ/mol) T (K) Method Reference Comment
25.307.PHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M

C12H8+ + Fluorene = (C12H8+ • Fluorene)

By formula: C12H8+ + C13H10 = (C12H8+ • C13H10)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr55.6kJ/molPHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr120.J/mol*KN/AMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M

Free energy of reaction

ΔrG° (kJ/mol) T (K) Method Reference Comment
23.283.PHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M

C13H10+ + Fluorene = (C13H10+ • Fluorene)

By formula: C13H10+ + C13H10 = (C13H10+ • C13H10)

Bond type: Charge transfer bond (positive ion)

Quantity Value Units Method Reference Comment
Δr69.0kJ/molPHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr120.J/mol*KN/AMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M

Free energy of reaction

ΔrG° (kJ/mol) T (K) Method Reference Comment
30.331.PHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M

C13H11+ + Fluorene = (C13H11+ • Fluorene)

By formula: C13H11+ + C13H10 = (C13H11+ • C13H10)

Quantity Value Units Method Reference Comment
Δr60.2kJ/molPHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr120.J/mol*KN/AMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr26.kJ/molPHPMSMeot-Ner (Mautner), 1980gas phase; Entropy change calculated or estimated; M

3Hydrogen + Fluorene = Fluorene, 1,2,3,4,4a,9a-hexahydro-, cis-

By formula: 3H2 + C13H10 = C13H16

Quantity Value Units Method Reference Comment
Δr-180.kJ/molEqkFrye and Weitkamp, 1969gas phase; ALS

Gas phase ion energetics data

Go To: Top, Gas phase thermochemistry data, Phase change data, Reaction thermochemistry data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
L - Sharon G. Lias

Data compiled as indicated in comments:
B - John E. Bartmess
MM - Michael M. Meot-Ner (Mautner)
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

View reactions leading to C13H10+ (ion structure unspecified)

Quantity Value Units Method Reference Comment
IE (evaluated)7.91 ± 0.02eVN/AN/AL
Quantity Value Units Method Reference Comment
Proton affinity (review)831.5kJ/molN/AHunter and Lias, 1998HL
Quantity Value Units Method Reference Comment
Gas basicity803.8kJ/molN/AHunter and Lias, 1998HL

Electron affinity determinations

EA (eV) Method Reference Comment
<0.278 ± 0.026ECDWojnarovits and Foldiak, 1981EA is an upper limit: Chen and Wentworth, 1989. G3MP2B3 calculations indicate an EA of ca. -0.1 eV, anion unbound.; B

Proton affinity at 298K

Proton affinity (kJ/mol) Reference Comment
828.0Aue, Guidoni, et al., 2000Experimental literature data re-evaluated by the authors using ab initio protonation entropies; MM

Gas basicity at 298K

Gas basicity (review) (kJ/mol) Reference Comment
800.8Aue, Guidoni, et al., 2000Experimental literature data re-evaluated by the authors using ab initio protonation entropies; MM

Ionization energy determinations

IE (eV) Method Reference Comment
7.88 ± 0.05EQMautner(Meot-Ner), 1980LLK
8.52EITerlouw, Heerma, et al., 1974LLK
7.89 ± 0.03PIPotapov, Kardash, et al., 1972LLK
7.93 ± 0.01PEDewar, Haselbach, et al., 1970RDSH
8.42CTSMukherjee, 1969RDSH
7.78CTSSlifkin and Allison, 1967RDSH
7.91PERuscic, Kovac, et al., 1978Vertical value; LLK
7.93 ± 0.02PEMaier and Turner, 1972Vertical value; LLK

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C13H9+12.5 ± 0.1HEIRapp, Staab, et al., 1970RDSH

De-protonation reactions

C13H9- + Hydrogen cation = Fluorene

By formula: C13H9- + H+ = C13H10

Quantity Value Units Method Reference Comment
Δr1466. ± 8.4kJ/molD-EARömer, Janaway, et al., 1997gas phase; B
Δr1472. ± 8.8kJ/molG+TSTaft and Bordwell, 1988gas phase; B
Δr1478. ± 11.kJ/molG+TSCumming and Kebarle, 1978gas phase; B
Quantity Value Units Method Reference Comment
Δr1434. ± 8.8kJ/molH-TSRömer, Janaway, et al., 1997gas phase; B
Δr1439. ± 8.4kJ/molIMRETaft and Bordwell, 1988gas phase; B
Δr1446. ± 8.4kJ/molIMRECumming and Kebarle, 1978gas phase; B

IR Spectrum

Go To: Top, Gas phase thermochemistry data, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, References, Notes

Data compiled by: Coblentz Society, Inc.

Data compiled by: Timothy J. Johnson, Tanya L. Myers, Yin-Fong Su, Russell G. Tonkyn, Molly Rose K. Kelly-Gorham, and Tyler O. Danby

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director


Mass spectrum (electron ionization)

Go To: Top, Gas phase thermochemistry data, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, IR Spectrum, Gas Chromatography, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

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Owner NIST Mass Spectrometry Data Center
Collection (C) 2014 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
Origin Japan AIST/NIMC Database- Spectrum MS-NW-1806
NIST MS number 228672

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Gas Chromatography

Go To: Top, Gas phase thermochemistry data, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillaryHP-5MS150.1597.Nahir, 199930. m/0.25 mm/0.25 μm
CapillaryOV-1150.1557.Zhang, Chen, et al., 199725. m/0.2 mm/0.33 μm, N2
CapillaryOV-1150.1557.Zhang, Chen, et al., 199725. m/0.2 mm/0.33 μm, N2
CapillaryOV-1160.1574.Zhang, Chen, et al., 199725. m/0.2 mm/0.33 μm, N2
CapillarySE-30180.1595.Korhonen and Lind, 1985N2; Column length: 25. m; Column diameter: 0.33 mm
CapillarySE-30130.1535.Bredael, 1982Column length: 100. m; Column diameter: 0.5 mm
CapillarySE-30175.1585.Bredael, 1982Column length: 100. m; Column diameter: 0.5 mm
CapillaryOV-101140.1552.1Gerasimenko, Kirilenko, et al., 1981N2; Column length: 50. m; Column diameter: 0.3 mm
PackedSE-30150.1561.Shlyakhov, Anvaer, et al., 1975 
PackedSE-30200.1609.Shlyakhov, Anvaer, et al., 1975 

Kovats' RI, non-polar column, custom temperature program

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Column type Active phase I Reference Comment
PackedSE-301580.Ramsey, Lee, et al., 1980He, Chromosorb G HP (80-100 mesh); Column length: 1.5 m; Program: not specified

Kovats' RI, polar column, isothermal

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Column type Active phase Temperature (C) I Reference Comment
PackedCarbowax 20M220.2374.Sellier, Tersac, et al., 1981Column length: 2. m

Van Den Dool and Kratz RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryHP-5MS1583.4Zeng, Zhao, et al., 200730. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 80. C; Tend: 300. C
CapillaryDB-51579.5Song, Lai, et al., 200330. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 40. C; Tend: 310. C
CapillaryDB-51578.9Song, Lai, et al., 200330. m/0.25 mm/0.25 μm, He, 40. C @ 5. min, 4. K/min; Tend: 310. C
CapillaryDB-51565.2Song, Lai, et al., 200330. m/0.25 mm/0.25 μm, He, 2. K/min; Tstart: 40. C; Tend: 310. C
CapillaryDB-51579.5Song, Lai, et al., 200330. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 40. C; Tend: 310. C
CapillaryDB-51587.9Song, Lai, et al., 200330. m/0.25 mm/0.25 μm, He, 6. K/min; Tstart: 40. C; Tend: 310. C
CapillaryOV-11590.5Zhang, Shen, et al., 200025. m/0.2 mm/0.33 μm, 5. K/min; Tstart: 100. C; Tend: 180. C
CapillaryOV-11611.0Zhang, Shen, et al., 200025. m/0.2 mm/0.33 μm, 5. K/min; Tstart: 100. C; Tend: 180. C
CapillaryHP-5MS1595.Nahir, 199930. m/0.25 mm/0.25 μm, 10. K/min; Tstart: 50. C; Tend: 300. C
CapillaryDB-51565.2Lai and Song, 199530. m/0.25 mm/0.25 μm, He, 2. K/min; Tstart: 40. C; Tend: 310. C
CapillaryDB-51579.5Lai and Song, 199530. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 40. C; Tend: 310. C
CapillaryDB-51587.9Lai and Song, 199530. m/0.25 mm/0.25 μm, He, 6. K/min; Tstart: 40. C; Tend: 310. C
CapillaryDB-51579.5Lai and Song, 199530. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 40. C; Tend: 310. C
CapillaryDB-51578.9Lai and Song, 199530. m/0.25 mm/0.25 μm, He, 40. C @ 5. min, 4. K/min; Tend: 310. C
CapillarySP-21001574.59Podmaniczky, Szepesy, et al., 1986H2, 2. K/min; Tstart: 170. C
CapillarySP-21001577.83Podmaniczky, Szepesy, et al., 1986H2, 4. K/min; Tstart: 170. C
CapillarySP-21001580.72Podmaniczky, Szepesy, et al., 1986H2, 6. K/min; Tstart: 170. C
CapillarySP-21001593.30Podmaniczky, Szepesy, et al., 1986H2, 2. K/min; Tstart: 170. C
CapillarySP-21001589.39Podmaniczky, Szepesy, et al., 1986H2, 4. K/min; Tstart: 170. C
CapillarySP-21001595.90Podmaniczky, Szepesy, et al., 1986H2, 6. K/min; Tstart: 170. C
CapillaryCP Sil 5 CB1590.56Podmaniczky, Szepesy, et al., 1986H2, 4. K/min; Tstart: 170. C
CapillaryDB-51594.Rostad and Pereira, 198630. m/0.26 mm/0.25 μm, He, 50. C @ 4. min, 6. K/min, 300. C @ 20. min
CapillarySE-301583.Korhonen and Lind, 1985N2, 10. K/min; Column length: 25. m; Column diameter: 0.33 mm; Tstart: 100. C; Tend: 320. C
CapillarySE-301587.Korhonen and Lind, 1985N2, 6. K/min; Column length: 25. m; Column diameter: 0.33 mm; Tstart: 140. C; Tend: 320. C
CapillarySE-521555.Beernaert, 1979He, 50. C @ 5. min, 6. K/min; Column length: 33.3 m; Column diameter: 0.50 mm; Tend: 320. C
CapillarySE-521555.87Lee, Vassilaros, et al., 197912. m/0.3 mm/0.34 μm, He, 2. K/min; Tstart: 50. C; Tend: 250. C
CapillarySE-521549.28Lee, Vassilaros, et al., 197912. m/0.28 mm/0.17 μm, He, 2. K/min; Tstart: 50. C; Tend: 250. C
CapillarySE-521555.Carugno and Rossi, 1967N2, 1.8 K/min; Column length: 65. m; Column diameter: 0.3 mm; Tstart: 100. C; Tend: 300. C

Van Den Dool and Kratz RI, non-polar column, custom temperature program

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Column type Active phase I Reference Comment
CapillaryHP-11552.98Dimitriou-Christidis, Harris, et al., 200330. m/0.25 mm/0.25 μm; Program: 60C => 7C/min => 225C => 15C/min => 300C(11.43min)
CapillaryHP-51586.39Dimitriou-Christidis, Harris, et al., 200330. m/0.25 mm/0.25 μm; Program: 60C => 7C/min => 225C => 15C/min => 300C(11.43min)
CapillaryDB-51604.Havenga and Rohwer, 199930. m/0.25 mm/0.25 μm, He; Program: 60 0C 7 0C/min -> 130 0C 5 0C/min -> 200 0C 6 0C/min -> 260 0C 20 0C/min -> 320 0C (4 min)
Capillary5 % Phenyl methyl siloxane1568.Yasuhara, Shiraishi, et al., 199725. m/0.31 mm/0.52 μm, He; Program: 50C(2min) => (20C/min) => 120C => (7C/min) => 310C(10min)
CapillaryMethyl Silicone1548.Oda, Ichikawa, et al., 1996Program: 50C (2min) => 20C/min => 160C => 5C/min => 210C => 10C/min => 300C
CapillaryMethyl Silicone1563.Oda, Ichikawa, et al., 1996Program: 50C (2min) => 20C/min => 160C => 5C/min => 210C => 10C/min => 300C

Van Den Dool and Kratz RI, polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillarySupelcowax-102337.Chung, Yung, et al., 200260. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min
CapillarySupelcowax-102337.Chung, Yung, et al., 200160. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min
CapillarySupelcowax-102338.Chung, 199960. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min

Normal alkane RI, non-polar column, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillaryOV-101120.1552.Nabivach and Gerasimenko, 1996 
CapillaryPolidimethyl siloxane130.1542.Nabivach and Gerasimenko, 1996 
CapillaryPolidimethyl siloxane130.1544.Nabivach and Gerasimenko, 1996 
CapillarySE-30200.1617.Korhonen and Lind, 1985N2; Column length: 25. m; Column diameter: 0.33 mm
PackedPolydimethyl siloxane147.1558.Ferrand, 1962 
PackedPolydimethyl siloxane183.1580.Ferrand, 1962 

Normal alkane RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryHP-5 MS1587.Radulovic, Blagojevic, et al., 201030. m/0.25 mm/0.25 μm, Helium, 5. K/min, 290. C @ 10. min; Tstart: 70. C
CapillaryDB-51598.Grung, Lichtenthaler, et al., 200730. m/0.25 mm/0.25 μm, 5. K/min, 280. C @ 10. min; Tstart: 40. C
CapillaryC103H2081593.Dumitrescu, Buda, et al., 2000H2, 5. K/min; Phase thickness: 0.25 μm; Tstart: 80. C; Tend: 275. C
CapillaryC103H2081593.Dumitrescu, Buda, et al., 2000H2, 4. K/min; Phase thickness: 0.25 μm; Tstart: 100. C; Tend: 275. C
CapillaryHP-51580.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-51581.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-51583.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-51583.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-51583.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-51584.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-51591.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-51592.Miao and Wu, 199930. m/0.32 mm/0.25 μm, 50. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryUltra-11558.Elizalde-González, Hutfliess, et al., 199650. m/0.2 mm/0.33 μm, H2, 3. K/min, 300. C @ 35. min; Tstart: 60. C
CapillaryDB-51559.Andersson and Weis, 199430. m/0.32 mm/0.25 μm, H2, 80. C @ 2. min, 4. K/min, 270. C @ 5. min
CapillaryUltra-11531.Okumura, 199125. m/0.32 mm/0.25 μm, He, 3. K/min; Tstart: 80. C; Tend: 260. C
CapillarySE-541572.Harland, Cumming, et al., 1986He, 50. C @ 2. min, 8. K/min, 250. C @ 12. min; Column length: 25. m; Column diameter: 0.32 mm

Normal alkane RI, non-polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillaryTR-5 MS1550.Kurashov, Mitrukova, et al., 201415. m/0.25 mm/0.25 μm, Helium; Program: 35 0C (3 min) 2 0C/min -> 60 0C (3 min) 2 0C/min -> 80 0C (3 min) 4 0C/min -> 120 0C (3 min) 5 0C/min -> 150 0C (3 min) 15 0C/min -> 240 0C (10 min)
CapillaryTR-5 MS1562.Kurashov, Krylova, et al., 201315. m/0.25 mm/0.25 μm, Helium; Program: 35 0C (3 min) 2 0C/min -> 60 0C (3 min) 2 0C/min -> 80 0C (3 min) 4 0C/min -> 120 0C (3 min) 5 0C/min -> 150 0C (3 mion) 15 0C/min -> 240 0C (10 min)
CapillaryHP-5MS1582.Vichi, Pizzale, et al., 200530. m/0.25 mm/0.25 μm; Program: 40C(3min) => 4C/min => 75C => 8C/min => 250C
CapillaryHP-51584.Ansorena, Astiasarán, et al., 200030. m/0.25 mm/0.25 μm, He; Program: 40C (10min) => 3C/min => 120C => 10C/min => 250C (5min)
CapillaryMethyl Silicone1563.Oda, Yasuhara, et al., 199825. m/0.25 mm/0.25 μm, He; Program: 50 0C (2 min) 20 0C/min -> 160 0C 5 0C/min -> 210 0C 10 0C/min -> 300 0C
CapillaryMethyl Silicone1559.Zenkevich, 1994Program: not specified
CapillaryPolydimethyl siloxane, unknown content of Ph-groups1593.Geldon, 1989Program: not specified
CapillaryPolydimethyl siloxane, unknown content of Ph-groups1594.Geldon, 1989Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.1547.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
OtherMethyl Silicone1580.Ardrey and Moffat, 1981Program: not specified

Normal alkane RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryTC-Wax2328.Miyazawa and Okuno, 2003He, 4. K/min, 250. C @ 30. min; Column length: 60. m; Column diameter: 0.25 mm; Tstart: 80. C

Normal alkane RI, polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillarySOLGel-Wax2322.Shu and Shen, 200830. m/0.53 mm/0.50 μm, Helium; Program: 40 0C 7 0C/min -> 180 0C 10 0C/min -> 240 0C (10 min)
CapillarySOLGel-Wax2322.Shu and Shen, 200830. m/0.53 mm/0.50 μm, Helium; Program: not specified
CapillarySupelcowax-102331.Vichi, Pizzale, et al., 200530. m/0.25 mm/0.25 μm; Program: 40C(3min) => 4C/min => 75C => 8C/min => 250C
CapillaryDB-Wax2311.Peng, Yang, et al., 1991Program: not specified

Lee's RI, non-polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryDB-5MS270.24Sun, Zhou, et al., 200830. m/0.25 mm/0.25 μm, 50. C @ 2. min, 6. K/min, 300. C @ 16. min
CapillaryPE-5270.1Jamoussi, Kanzari, et al., 200720. m/0.18 mm/0.18 μm, 50. C @ 1.5 min, 8. K/min; Tend: 345. C
CapillaryHP-5270.8Wang, Hou, et al., 200730. m/0.30 mm/0.25 μm, Helium, 50. C @ 5. min, 5. K/min, 200. C @ 15. min
CapillaryHP-5271.Shao, Wang, et al., 200630. m/0.3 mm/0.25 μm, He, 50. C @ 5. min, 5. K/min, 200. C @ 15. min
Capillary5 % Phenyl methyl siloxane268.17Skrbic and Onjia, 20062. K/min; Tstart: 50. C; Tend: 250. C
Capillary5 % Phenyl methyl siloxane269.60Skrbic and Onjia, 200680. C @ 2. min, 8. K/min, 300. C @ 10. min
CapillaryHP-5270.32Pedersen, Durant, et al., 200530. m/0.25 mm/0.25 μm, Helium, 50. C @ 1.5 min, 6. K/min, 310. C @ 10. min
CapillaryHP-5269.94Marynowski, Pieta, et al., 200460. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 35. C; Tend: 300. C
CapillaryHP-5269.94Marynowski, Pieta, et al., 200460. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 35. C; Tend: 300. C
CapillaryDB-5MS270.57Chen, Keeran, et al., 200230. m/0.25 mm/0.5 μm, 40. C @ 1. min, 10. K/min; Tend: 310. C
CapillaryDB-5MS270.28Chen, Keeran, et al., 200230. m/0.25 mm/0.5 μm, 40. C @ 1. min, 4. K/min; Tend: 310. C
CapillaryPTE-5270.23Wang, Jia, et al., 200030. m/0.25 mm/0.25 μm, 60. C @ 1.5 min, 8. K/min, 300. C @ 12.5 min
CapillaryHP-5270.16Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.24Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.26Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.30Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.58Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.66Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.68Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.73Miao and Wu, 199950. C @ 2. min, 5. K/min; Tend: 310. C
CapillaryHP-5270.01Piao, Chu, et al., 199930. m/0.25 mm/0.25 μm, 50. C @ 2. min, 4. K/min, 280. C @ 20. min
CapillaryHP-5270.32Piao, Chu, et al., 199930. m/0.25 mm/0.25 μm, 50. C @ 2. min, 4. K/min, 280. C @ 20. min
CapillaryDB-5268.2Durlak, Biswas, et al., 199830. m/0.25 mm/0.25 μm, 15. K/min; Tstart: 50. C; Tend: 300. C
CapillaryDB-5268.2Durlak, Biswas, et al., 199830. m/0.25 mm/0.25 μm, 15. K/min; Tstart: 50. C; Tend: 300. C
CapillaryHT-5270.49Williams and Williams, 199840. C @ 8. min, 5. K/min, 400. C @ 20. min; Column length: 25. m; Column diameter: 0.32 mm
CapillarySE-52269.55Wang, Peng, et al., 19974. K/min; Column length: 30. m; Column diameter: 0.30 mm; Tstart: 40. C; Tend: 250. C
CapillarySE-54267.40Chen, 19964. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 300. C
CapillaryDB-5269.92Williams and Horne, 1995He, 60. C @ 2. min, 5. K/min; Column length: 25. m; Column diameter: 0.3 mm; Tend: 270. C
CapillaryDB-5268.37Andersson and Weis, 199430. m/0.32 mm/0.25 μm, H2, 80. C @ 2. min, 4. K/min, 270. C @ 5. min
CapillarySE-52270.18Shaogang and Xiaobai, 199440. C @ 2. min, 4. K/min, 300. C @ 20. min; Column length: 30. m; Column diameter: 0.25 mm
CapillaryDB-5270.30Wang, Fingas, et al., 199430. m/0.32 mm/0.25 μm, He, 50. C @ 2. min, 6. K/min; Tend: 300. C
CapillaryDB-5270.4Donnelly, Abdel-Hamid, et al., 199330. m/0.32 mm/0.25 μm, He, 40. C @ 3. min, 8. K/min, 285. C @ 29.5 min
CapillaryCP Sil 8 CB269.9Bundt, Herbel, et al., 199150. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 80. C; Tend: 300. C
CapillarySE-54270.00Guillén, Blanco, et al., 198920. m/0.22 mm/0.20 μm, He, 4. K/min; Tstart: 50. C; Tend: 300. C
CapillarySE-52268.23Hasegawa, Muragishi, et al., 19883. K/min; Column length: 25. m; Column diameter: 0.25 mm; Tstart: 130. C; Tend: 260. C
CapillaryDB-5267.45Sye, Lin, et al., 198830. m/0.32 mm/0.25 μm, 80. C @ 1. min, 3. K/min; Tend: 290. C
CapillaryDB-5269.94Wise, Benner, et al., 198830. m/0.25 mm/0.25 μm, 40. C @ 2. min, 4. K/min, 280. C @ 5. min
CapillarySE-52268.17Boenke and Ballschmiter, 1987Hydrogen, 3. K/min; Column length: 12. m; Tstart: 120. C; Tend: 285. C
CapillaryDB-5270.77Rostad and Pereira, 198630. m/0.26 mm/0.25 μm, He, 50. C @ 4. min, 6. K/min, 300. C @ 20. min
CapillaryDB-5267.04Tong, Centen, et al., 1985He, 4. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 90. C; Tend: 325. C
CapillaryDB-5266.2Viau, Studak, et al., 1984Helium, 4. K/min; Column length: 30. m; Column diameter: 0.32 mm; Tstart: 90. C; Tend: 250. C
CapillarySE-52269.73Vassilaros, Kong, et al., 198220. m/0.30 mm/0.25 μm, H2, 40. C @ 2. min, 4. K/min; Tend: 265. C
CapillarySE-52268.17Lee, Vassilaros, et al., 197912. m/0.3 mm/0.34 μm, He, 2. K/min; Tstart: 50. C; Tend: 250. C

Lee's RI, non-polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillaryDB-5270.6Fuentes, Font, et al., 2007Column length: 60. m; Program: not specified
CapillaryHP-5MS270.39Wang, Li, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 6C/min => 258C => 2C/min => 300C(4min)
CapillaryHP-5MS269.94Wang, Li, et al., 2007, 230. m/0.25 mm/0.25 μm, He; Program: not specified
CapillaryHP-5MS270.39Wang, Li, et al., 2007, 230. m/0.25 mm/0.25 μm, He; Program: not specified
CapillaryDB-5MS270.3Aracil, Font, et al., 2005Column length: 60. m; Column diameter: 0.25 mm; Program: not specified
CapillaryHP-5MS269.83Cheng, Liu, et al., 200530. m/0.30 mm/0.25 μm, He; Program: 50 0C (2 min) 8 0C/min -> 120 0C (3 min) 10 0C/min -> 230 0C
CapillaryLM-5262.Ré-Poppi and Santiago-Silva, 200530. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 15C/min => 180C => 5C/min => 280C (10min)
CapillaryLM-5262.11Ré-Poppi and Santiago-Silva, 200530. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 15C/min => 180C => 5C/min => 280C (10min)
CapillaryUltra-1268.2Sremac, Skrbic, et al., 200550. m/0.32 mm/0.50 μm, Nitrogen; Program: 40-100 0C 3-15 0C/min -> 290 0C
CapillaryUltra-1269.4Sremac, Skrbic, et al., 200550. m/0.32 mm/0.50 μm, Nitrogen; Program: 40-100 0C 3-15 0C/min -> 290 0C
CapillaryUltra-1269.6Sremac, Skrbic, et al., 200550. m/0.32 mm/0.50 μm, Nitrogen; Program: 40-100 0C 3-15 0C/min -> 290 0C
CapillaryDB-5269.6Lundstedt, Haglund, et al., 200330. m/0.25 mm/0.25 μm; Program: not specified
CapillaryLM-5262.04Ré-Poppi and Santiago-Silva, 200230. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 15C/min => 180C => 5C/min => 280C(5min)
CapillaryLM-5262.11Ré-Poppi and Santiago-Silva, 200230. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 15C/min => 180C => 5C/min => 280C(5min)
CapillaryDB-5267.7Zamperlini, Silva, et al., 199730. m/0.25 mm/0.25 μm, He; Program: 90C (1min) => 10C/min => 120C => 4C/min => 310C (20min)
CapillaryDB-5268.18Zamperlini, Silva, et al., 199730. m/0.25 mm/0.25 μm, He; Program: 90C (1min) => 10C/min => 120C => 4C/min => 310C (20min)
CapillarySE-54268.17Chen, 1996Column length: 30. m; Column diameter: 0.25 mm; Program: not specified
CapillarySE-52269.73Shaogang and Xiaobai, 1994Column length: 30. m; Column diameter: 0.25 mm; Program: not specified
CapillarySE-54269.22Guillen, Iglesias, et al., 1992Program: not specified
CapillaryDB-5270.1Paschke, Herbel, et al., 199230. m/0.25 mm/0.25 μm, He; Program: 60 0C (3 min) 10 0C/min -> 100 0C (3 min) 5 0C/min -> 300 0C
CapillaryCP Sil 8 CB269.7Bundt, Herbel, et al., 199150. m/0.25 mm/0.25 μm, He; Program: not specified
CapillaryCP Sil 8 CB270.0Bundt, Herbel, et al., 199150. m/0.25 mm/0.25 μm, He; Program: not specified
CapillarySE-54269.7Peterman and Delfino, 199015. m/0.25 mm/0.25 μm, He; Program: 125 0C (15 min) 1 0C/min -> 131 0C 4 0C/min -> 247 0C 8 0C/min -> 280 0C (15 min)
CapillaryDB-5267.53Naikwadi, Charbonneau, et al., 1987Column length: 30. m; Column diameter: 0.32 mm; Program: not specified
CapillaryDB-5268.17Naikwadi, Charbonneau, et al., 1987Column length: 30. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-101270.8Tucminen, Wickstrom, et al., 1986Program: not specified
CapillaryDB-5268.17Tong, Centen, et al., 1985He; Column length: 30. m; Column diameter: 0.25 mm; Program: not specified
CapillarySE-52267.19Shlyakhov, 1984Program: not specified
CapillarySE-52267.39Shlyakhov, 1984Program: not specified
CapillarySE-52268.17Shlyakhov, 1984Program: not specified

Lee's RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryDB-Wax264.34Andersson and Weis, 199430. m/0.2 mm/0.15 μm, H2, 80. C @ 2. min, 4. K/min, 270. C @ 5. min

References

Go To: Top, Gas phase thermochemistry data, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Roux, Temprado, et al., 2008
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Weast and Grasselli, 1989
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Notes

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