CCCBDB listing of experimental data page 2

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Property	Value	units	Reference
Hfg(298.15K)	510.45	kJ mol^-1	webbook
Hfg(0K)		kJ mol^-1	webbook
Entropy (298.15K)	233.47	J K^-1 mol^-1	webbook
Heat Capacity (298.15K)	36.13	J K^-1 mol^-1

Mode Number	Symmetry	Frequency			Intensity			Comment	Description
Mode Number	Symmetry	Fundamental(cm^-1)	Harmonic(cm^-1)	Reference	(km mol^-1)	unc.	Reference	Comment	Description
1	Σ	720	728	1997Mar/Sea:413

Description	Value	unc.	Connectivity				Reference	Comment
Description	Value	unc.	Atom 1	Atom 2	Atom 3	Atom 4	Reference	Comment
rCBr	1.821	0.001	1	2			1963Dix/Kro:1484

Atom	x (Å)	y (Å)	z (Å)
C1	0.0000	0.0000	0.0000
Br2	0.0000	0.0000	1.8210

	C1	Br2
C1		1.8210
Br2	1.8210

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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State	Config	State description	Conf description	Exp. min.	Dipole (Debye)				Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	x	y	z	total	Reference	comment	Point Group	dipole	quadrupole
1	1	²Π	C_∞v	True							C_∞v	1	1

squib	reference	DOI
1963Dix/Kro:1484	RN Dixon, HW Kroto "High-Resolution Study of the Spectrum of the CBr Radical" Trans. Faraday Soc., 1963,59, 1484-1489	10.1039/TF9635901484
1997Mar/Sea:413	AJ Marr, TJ Sears, PB Davies "High-Resolution Diode Laser Spectroscopy of CBr" J. Molecular Spectroscopy 184, 413-433 (1997)	10.1006/jmsp.1997.7349
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Experimental data for CBr (Carbon monobromide)