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	hartrees
Energy at 0K	-2650.257734
Energy at 298.15K	-2650.263268
HF Energy	-2649.834474
Nuclear repulsion energy	143.877655

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3253	3114	4.99
2	A'	3221	3084	5.44
3	A'	3156	3022	0.83
4	A'	1667	1596	34.87
5	A'	1423	1363	10.25
6	A'	1306	1250	23.63
7	A'	1043	999	9.56
8	A'	623	596	19.33
9	A'	351	336	0.02
10	A"	967	926	49.34
11	A"	899	861	26.16
12	A"	587	562	16.09

Atom	x (Å)	y (Å)
C1	0.462	-1.113
C2	-0.446	-2.090
Br3	0.000	0.729
H4	1.534	-1.283
H5	-0.119	-3.127
H6	-1.514	-1.894

	C1	C2	Br3	H4	H5	H6
C1		1.3337	1.8997	1.0853	2.0961	2.1250
C2	1.3337		2.8543	2.1384	1.0877	1.0862
Br3	1.8997	2.8543		2.5304	3.8584	3.0285
H4	1.0853	2.1384	2.5304		2.4767	3.1091
H5	2.0961	1.0877	3.8584	2.4767		1.8627
H6	2.1250	1.0862	3.0285	3.1091	1.8627

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.570	C1	C2	H6	122.497
C2	C1	Br3	122.994	C2	C1	H4	123.931
Br3	C1	H4	113.075	H5	C2	H6	117.933

All results from a given calculation for C₂H₃Br (vinyl bromide)

using model chemistry: QCISD/6-311G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for C2H3Br (vinyl bromide)

using model chemistry: QCISD/6-311G*

States and conformations

All results from a given calculation for C₂H₃Br (vinyl bromide)