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	hartrees
Energy at 0K	-2637.291198
Energy at 298.15K	-2637.296914
Nuclear repulsion energy	144.781028

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3422	3089	6.47
2	A'	3404	3073	2.64
3	A'	3330	3006	0.77
4	A'	1816	1639	32.19
5	A'	1571	1418	11.55
6	A'	1429	1290	34.88
7	A'	1157	1044	8.23
8	A'	656	592	23.20
9	A'	379	343	0.09
10	A"	1135	1024	19.95
11	A"	1109	1001	77.13
12	A"	668	603	17.13

Atom	x (Å)	y (Å)
C1	0.458	-1.118
C2	-0.439	-2.073
Br3	0.000	0.726
H4	1.513	-1.284
H5	-0.133	-3.101
H6	-1.491	-1.871

	C1	C2	Br3	H4	H5	H6
C1		1.3099	1.8999	1.0686	2.0693	2.0892
C2	1.3099		2.8328	2.1059	1.0731	1.0711
Br3	1.8999	2.8328		2.5158	3.8294	2.9945
H4	1.0686	2.1059	2.5158		2.4524	3.0613
H5	2.0693	1.0731	3.8294	2.4524		1.8323
H6	2.0892	1.0711	2.9945	3.0613	1.8323

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	120.218	C1	C2	H6	122.358
C2	C1	Br3	122.845	C2	C1	H4	124.290
Br3	C1	H4	112.865	H5	C2	H6	117.423

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

using model chemistry: HF/3-21G*

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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Number	Element	Mulliken
1	C	-0.267
2	C	-0.420
3	Br	-0.063
4	H	0.270
5	H	0.235
6	H	0.245

	x	y	z	Total
	0.213	-1.607	0.000	1.621
CHELPG
AIM
ESP

	x	y	z
x	4.503	0.699	0.000
y	0.699	7.727	0.000
z	0.000	0.000	2.211

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: HF/3-21G*

States and conformations

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