Manganese, tricarbonyl(η5-2,4-cyclopentadien-1-yl)-
- Formula: C8H5MnO3
- Molecular weight: 204.0615
- IUPAC Standard InChIKey: CZPHEHHRMHXAIK-UHFFFAOYSA-N
- CAS Registry Number: 12079-65-1
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Manganese, tricarbonyl-π-cyclopentadienyl-; π-Cyclopentadienylmanganese tricarbonyl; Cyclopentadienylmanganese tricarbonyl; Cyclopentadienyltricarbonylmanganese; Cymantrene; Manganese, cyclopentadienyltricarbonyl-; Tricarbonyl-π-cyclopentadienylmanganese; Tricarbonylcyclopentadienylmanganese; (η5-Cyclopentadienyl) manganese tricarbonyl; Cyklopentadientrikarbonylmanganium; MCT; Tricarbonyl(η5-cyclopentadienyl)manganese; tricarbonyl(η-cyclopentadienyl)manganese
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Gas phase thermochemistry data
Go To: Top, Condensed phase thermochemistry data, Reaction thermochemistry data, 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: José A. Martinho Simões
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | -113.2 ± 1.3 | kcal/mol | Review | Martinho Simões | |
ΔfH°gas | -117.2 ± 2.2 | kcal/mol | Review | Martinho Simões | |
ΔfH°gas | -102. ± 0.7 | kcal/mol | Review | Martinho Simões | |
ΔfH°gas | -115.2 ± 2.2 | kcal/mol | Review | Martinho Simões | Selected data. Average of the values from Evstigneeva and Shmyreva, 1965 and Lautsch, Erzberger, et al., 1958 |
Condensed phase thermochemistry data
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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:
MS - José A. Martinho Simões
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°solid | -125.7 ± 1.1 | kcal/mol | Review | Martinho Simões | MS |
ΔfH°solid | -129.7 ± 2.0 | kcal/mol | Review | Martinho Simões | MS |
ΔfH°solid | -127.7 ± 2.0 | kcal/mol | Review | Martinho Simões | Selected data. Average of the values from Evstigneeva and Shmyreva, 1965 and Lautsch, Erzberger, et al., 1958; MS |
ΔfH°solid | -114. ± 0.2 | kcal/mol | CC-SB | Chipperfield, Sneyd, et al., 1979 | Value corrected based on a set of ancillary data by J.A. Martinho Simões; The value for the enthalpy of combustion is not reported in Chipperfield, Sneyd, et al., 1979; MS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -922.1 ± 1.0 | kcal/mol | CC-SB | Evstigneeva and Shmyreva, 1965 | Please also see Pedley and Rylance, 1977 and Cox and Pilcher, 1970.; MS |
ΔcH°solid | -918.1 ± 2.0 | kcal/mol | CC-SB | Lautsch, Tröber, et al., 1963 | Please also see Lautsch, Erzberger, et al., 1958, Pedley and Rylance, 1977, and Cox and Pilcher, 1970.; MS |
Quantity | Value | Units | Method | Reference | Comment |
S°solid,1 bar | 61.986 | cal/mol*K | N/A | Chhor, Pommier, et al., 1983 | DH |
Constant pressure heat capacity of solid
Cp,solid (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
51.336 | 298.15 | Chhor, Pommier, et al., 1983 | T = 10 to 300 K.; DH |
Reaction thermochemistry data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: José A. Martinho Simões
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
(solution) + (solution) = C14H21MnO2 (solution) + (solution)
By formula: C8H5MnO3 (solution) + C7H16 (solution) = C14H21MnO2 (solution) + CO (solution)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 47. ± 2. | kcal/mol | AVG | N/A | Average of 18 values; Individual data points |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Reaction thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Martinho Simões
Martinho Simões, J.A.,
Private communication (see http://webbook.nist.gov/chemistry/om/). [all data]
Evstigneeva and Shmyreva, 1965
Evstigneeva, E.V.; Shmyreva, G.O.,
Russ. J. Phys. Chem., 1965, 39, 529. [all data]
Lautsch, Erzberger, et al., 1958
Lautsch, W.F.; Erzberger, P.; Tröber, A.,
Wiss. Z. Tech. Hochsch. Chem. Leuna-Merseburg, 1958, 1, 31. [all data]
Chipperfield, Sneyd, et al., 1979
Chipperfield, J.R.; Sneyd, J.C.R.; Webster, D.E.,
J. Organometal. Chem., 1979, 178, 177. [all data]
Pedley and Rylance, 1977
Pedley, J.B.; Rylance, J.,
Computer Analysed Thermochemical Data: Organic and Organometallic Compounds, University of Sussex, Brigton, 1977. [all data]
Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G.,
Thermochemistry of Organic and Organometallic Compounds
in Academic Press, New York, 1970. [all data]
Lautsch, Tröber, et al., 1963
Lautsch, W.F.; Tröber, A.; Zimmer, W.; Mehner, L.; Linck, W.; Lehmann, H.M.; Brandenberger, H.; Korner, H.; Metschker, H.-J.; Wagner, K.; Kaden, R.,
Z. Chem., 1963, 3, 415. [all data]
Chhor, Pommier, et al., 1983
Chhor, K.; Pommier, C.; Diot, M.,
Low-temperature thermodynamic study of cymantrene (C5H5Mn(CO)3) and azacymantrene (C4H4NMn(CO)3),
Mol. Cryst. Liq. Cryst., 1983, 100, 193-209. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Reaction thermochemistry data, References
- Symbols used in this document:
Cp,solid Constant pressure heat capacity of solid S°solid,1 bar Entropy of solid at standard conditions (1 bar) ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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