Pyrazine
- Formula: C4H4N2
- Molecular weight: 80.0880
- IUPAC Standard InChIKey: KYQCOXFCLRTKLS-UHFFFAOYSA-N
- CAS Registry Number: 290-37-9
- 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: p-Diazine; Paradiazine; Piazine; 1,4-Diazabenzene; 1,4-Diazine
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Condensed phase thermochemistry data
Go To: Top, IR Spectrum, 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°liquid | 33.41 ± 0.28 | kcal/mol | Ccb | Tjebbes, 1962 | ALS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°liquid | -546.25 ± 0.28 | kcal/mol | Ccb | Tjebbes, 1962 | ALS |
Constant pressure heat capacity of solid
Cp,solid (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
43.0 | 298. | Boyd, Comper, et al., 1979 | crystaline, III phase; T = 295 to 312 K. Data graphically only.; DH |
IR Spectrum
Go To: Top, Condensed phase 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: Coblentz Society, Inc.
Condensed Phase Spectrum
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Notice: Except where noted, spectra from this collection were measured on dispersive instruments, often in carefully selected solvents, and hence may differ in detail from measurements on FTIR instruments or in other chemical environments. More information on the manner in which spectra in this collection were collected can be found here.
Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.
Additional Data
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Owner | COPYRIGHT (C) 1988 by COBLENTZ SOCIETY INC. Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | DOW CHEMICAL COMPANY |
Source reference | COBLENTZ NO. 5739 |
Date | 1965/11/12 |
State | SOLUTION (10% CCl4 FOR 2.6-7.5, 10% CS2 FOR 7.5-24 MICRON) |
Instrument | BECKMAN IR-9 (GRATING) |
Instrument parameters | ORDER CHANGES: 670, 1200, 2000 CM-1 |
Path length | 0.012 CM, 0.012 CM SPECTRAL CONTAMINATION DUE TO CS2 AROUND 400, 850 AND CCl4 AROUND 1550 CM-1 HAVE BEEN SUBTRACTED |
Resolution | 2 |
Sampling procedure | TRANSMISSION |
Data processing | DIGITIZED BY COBLENTZ SOCIETY (BATCH I) FROM HARD COPY |
Melting point | 53 C |
Boiling point | 116 C |
References
Go To: Top, Condensed phase thermochemistry data, IR Spectrum, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Tjebbes, 1962
Tjebbes, J.,
The heats of combustion and formation of the three diazines and their resonance energies,
Acta Chem. Scand., 1962, 16, 916-921. [all data]
Boyd, Comper, et al., 1979
Boyd, R.K.; Comper, J.; Ferguson, G.,
Entropy changes and structural implications for crystalline phases of pyrazine,
Can. J. Chem., 1979, 57, 3056-3060. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, IR Spectrum, References
- Symbols used in this document:
Cp,solid Constant pressure heat capacity of solid ΔcH°liquid Enthalpy of combustion of liquid at standard conditions ΔfH°liquid Enthalpy of formation of liquid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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