CCCBDB listing of experimental data page 2

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Property	Value	Uncertainty	units	Reference
Hfg(298.15K)	-63.60	2.10	kJ mol^-1	1979Kud/Kud:519
Hfg(0K)		2.10	kJ mol^-1	1979Kud/Kud:519
Entropy (298.15K)			J K^-1 mol^-1
Integrated Heat Capacity (0 to 298.15K)			kJ 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	A'	2988		webbook
2	A'	2937		webbook
3	A'	2880		webbook
4	A'	1451		webbook
5	A'	1451		webbook
6	A'	1386		webbook
7	A'	1252		webbook
8	A'	1061		webbook
9	A'	964		webbook
10	A'	583		webbook
11	A'	290		webbook
12	A"	3018		webbook
13	A"	2988		webbook
14	A"	1451		webbook
15	A"	1248		webbook
16	A"	964		webbook
17	A"	770		webbook
18	A"	247		webbook

Description	Value	unc.	Connectivity				Reference	Comment
Description	Value	unc.	Atom 1	Atom 2	Atom 3	Atom 4	Reference	Comment
rCH	1.093		1	6			1979Kud/Kud:519
rCH	1.087		2	4			1979Kud/Kud:519
rCBr	1.950		2	3			1979Kud/Kud:519
rCC	1.518		1	2			1979Kud/Kud:519
aHCH	108.9		6	1	7		1979Kud/Kud:519
aHCH	109.9		4	2	5		1979Kud/Kud:519
aCCBr	111		1	2	3		1979Kud/Kud:519
aHCC	112.2		1	2	4		1979Kud/Kud:519
aHCBr	105.4		3	2	4		1979Kud/Kud:519
aHCC	110		2	1	6		1979Kud/Kud:519	by symmetry

Bond Type	Count
C-C	1
C-Br	1
H-C	5

Atom 1	Atom 2
C1	C2
C1	H6
C1	H7
C1	H8
C2	Br3
C2	H4
C2	H5

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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You are here: Experimental > One molecule all properties

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	¹A^'	C_s	True				2.030	NSRDS-NBS10	DT	C_s	2	3

squib	reference	DOI
1979Kud/Kud:519	SA Kudchadker, AP Kudchadker "Ideal Gas Thermodynamic Properties of Selected Bromoethanes and Iodoethane" J. Phys. Chem. Ref. Data 8(2) 519, 1979	10.1063/1.555601
HCP_Polar	TM Miller, Handbook of Chemistry and Physics Online (http://hbcponline.com/faces/documents/10_04/10_04_0001.xhtml)
NSRDS-NBS10	R. D. Nelson Jr., D. R. Lide, A. A. Maryott "Selected Values of electric dipole moments for molecules in the gas phase" NSRDS-NBS10, 1967	10.6028/NBS.NSRDS.10
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Experimental data for C2H5Br (Ethyl bromide)

Experimental data for C₂H₅Br (Ethyl bromide)