Cyanamide
- Formula: CH2N2
- Molecular weight: 42.0400
- IUPAC Standard InChIKey: XZMCDFZZKTWFGF-UHFFFAOYSA-N
- CAS Registry Number: 420-04-2
- 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: H2NCN; carbamonitrile; Amidocyanogen; Carbimide; Cyanoamine; Cyanogen nitride; Cyanogenamide; Hydrogen cyanamide; N-Cyanoamine; USAF EK-1995; Alzogur; Deurbraak; Dormex; NSC 24133; TsAKS
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Condensed phase thermochemistry data
Go To: Top, Phase change data, Reaction thermochemistry data, 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 as indicated in comments:
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 |
---|---|---|---|---|---|
ΔfH°solid | 14.05 | kcal/mol | Ccb | Salley and Gray, 1951 | correction of Salley and Gray, 1948; ALS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -176.42 | kcal/mol | Ccb | Salley and Gray, 1951 | correction of Salley and Gray, 1948; ALS |
Constant pressure heat capacity of solid
Cp,solid (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
18.7 | 300. | DeWit, DeKruif, et al., 1983 | T = 90 to 300 K. Linearly extrapolated.; DH |
Phase change data
Go To: Top, Condensed phase thermochemistry data, Reaction thermochemistry data, 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 as indicated in comments:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Ttriple | 318.71 | K | N/A | De Wit, De Kruif, et al., 1983 | Uncertainty assigned by TRC = 0.02 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔsubH° | 18.0 | kcal/mol | N/A | De Wit, Van Miltenburg, et al., 1983 | AC |
Enthalpy of sublimation
ΔsubH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
18.1 | 290. | TE,ME | De Wit, Van Miltenburg, et al., 1983 | Based on data from 227. to 289. K.; AC |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
1.738 | 318.71 | DeWit, DeKruif, et al., 1983 | DH |
2.09 | 317.2 | Acree, 1991 | AC |
Entropy of fusion
ΔfusS (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
5.454 | 318.71 | DeWit, DeKruif, et al., 1983 | DH |
Reaction thermochemistry data
Go To: Top, Condensed phase thermochemistry data, Phase change data, 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: John E. Bartmess
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
CHN2- + =
By formula: CHN2- + H+ = CH2N2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 350.7 ± 2.3 | kcal/mol | G+TS | Koppel, Taft, et al., 1994 | gas phase; DH: 99±3, 97BOR/JI 2 |
ΔrH° | 349.2 ± 2.8 | kcal/mol | G+TS | Cacace, Depetris, et al., 1993 | gas phase |
ΔrH° | 351.9 ± 3.2 | kcal/mol | G+TS | Kroeker and Kass, 1990 | gas phase; Between tBuSH, HOAc |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 344.1 ± 2.0 | kcal/mol | IMRE | Koppel, Taft, et al., 1994 | gas phase; DH: 99±3, 97BOR/JI 2 |
ΔrG° | 342.6 ± 2.5 | kcal/mol | IMRE | Cacace, Depetris, et al., 1993 | gas phase |
ΔrG° | 345.3 ± 3.0 | kcal/mol | IMRB | Kroeker and Kass, 1990 | gas phase; Between tBuSH, HOAc |
Mass spectrum (electron ionization)
Go To: Top, Condensed phase thermochemistry data, Phase change 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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
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-IW-2370 |
NIST MS number | 238424 |
References
Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Salley and Gray, 1951
Salley, D.J.; Gray, J.B.,
Heats of combustion of some organic nitrogen compounds,
J. Am. Chem. Soc., 1951, 73, 5925. [all data]
Salley and Gray, 1948
Salley, D.J.; Gray, J.B.,
Heats of combustion of some organic nitrogen compounds,
J. Am. Chem. Soc., 1948, 70, 2650-2653. [all data]
DeWit, DeKruif, et al., 1983
DeWit, H.G.M.; DeKruif, C.G.; Van Miltenburg, J.C.,
Thermodynamic properties of molecular organic crystals containing organic crystals containing nitrogen, oxygen, and sulfur. II. Molar heat capacities of eight compounds by adiabatic calorimetry,
J. Chem. Thermodynam., 1983, 15, 891-902. [all data]
De Wit, De Kruif, et al., 1983
De Wit, H.G.M.; De Kruif, C.G.; Van Miltenburg, J.C.,
Thermodynamic properties of molecular organic crystals containing nitrogen, oxygen, and sulfur II. Molar heat capacities of eight compounds by adiabatic calorimetry,
J. Chem. Thermodyn., 1983, 15, 9, 891, https://doi.org/10.1016/0021-9614(83)90095-2
. [all data]
De Wit, Van Miltenburg, et al., 1983
De Wit, H.G.M.; Van Miltenburg, J.C.; De Kruif, C.G.,
Thermodynamic properties of molecular organic crystals containing nitrogen, oxygen, and sulphur 1. Vapour pressures and enthalpies of sublimation,
The Journal of Chemical Thermodynamics, 1983, 15, 7, 651-663, https://doi.org/10.1016/0021-9614(83)90079-4
. [all data]
Acree, 1991
Acree, William E.,
Thermodynamic properties of organic compounds: enthalpy of fusion and melting point temperature compilation,
Thermochimica Acta, 1991, 189, 1, 37-56, https://doi.org/10.1016/0040-6031(91)87098-H
. [all data]
Koppel, Taft, et al., 1994
Koppel, I.A.; Taft, R.W.; Anvia, F.; Zhu, S.Z.; Hu, L.Q.; Sung, K.S.; Desmarteau, D.D.; Yagupolskii, L.M.,
The Gas-Phase Acidities of Very Strong Neutral Bronsted Acids,
J. Am. Chem. Soc., 1994, 116, 7, 3047, https://doi.org/10.1021/ja00086a038
. [all data]
Cacace, Depetris, et al., 1993
Cacace, F.; Depetris, G.; Grandinetti, F.; Occhiucci, G.,
Gas-Phase Ion Chemistry of Cyanamide - A Mass Spectrometric and Abinitio Study of Gaseous [H2N-CN]+, [H2N-CN]H+, and [HN-CN]- Ions,
J. Phys. Chem., 1993, 97, 16, 4239, https://doi.org/10.1021/j100118a048
. [all data]
Kroeker and Kass, 1990
Kroeker, R.L.; Kass, S.R.,
Diazirinyl Anion: A Cyclic 4-pi Electron System,
J. Am. Chem. Soc., 1990, 112, 24, 9024, https://doi.org/10.1021/ja00180a082
. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Mass spectrum (electron ionization), References
- Symbols used in this document:
Cp,solid Constant pressure heat capacity of solid Ttriple Triple point temperature ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions ΔfusH Enthalpy of fusion ΔfusS Entropy of fusion ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions ΔsubH Enthalpy of sublimation ΔsubH° Enthalpy of sublimation at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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