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	hartrees
Energy at 0K	-176.974376
Energy at 298.15K
HF Energy	-176.974376
Nuclear repulsion energy	67.731807

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3204	3171	0.05	46.72	0.71	0.83
2	A'	3113	3081	6.89	168.57	0.21	0.34
3	A'	3097	3065	4.21	21.95	0.37	0.54
4	A'	1697	1680	113.52	17.62	0.06	0.12
5	A'	1340	1326	5.82	1.97	0.62	0.76
6	A'	1275	1262	3.82	14.75	0.63	0.77
7	A'	1169	1157	108.61	2.41	0.19	0.32
8	A'	915	906	21.66	4.06	0.43	0.60
9	A'	471	466	3.51	1.70	0.67	0.80
10	A"	931	921	31.78	0.85	0.75	0.86
11	A"	833	824	64.02	1.39	0.75	0.86
12	A"	718	710	4.98	4.37	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.429
C2	1.180	-0.157
F3	-1.140	-0.261
H4	-0.173	1.511
H5	1.266	-1.245
H6	2.084	0.451

	C1	C2	F3	H4	H5	H6
C1		1.3181	1.3326	1.0951	2.0992	2.0846
C2	1.3181		2.3229	2.1477	1.0914	1.0895
F3	1.3326	2.3229		2.0185	2.5996	3.3021
H4	1.0951	2.1477	2.0185		3.1087	2.4934
H5	2.0992	1.0914	2.5996	3.1087		1.8833
H6	2.0846	1.0895	3.3021	2.4934	1.8833

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	120.910	C1	C2	H6	119.651
C2	C1	F3	122.398	C2	C1	H4	125.482
F3	C1	H4	112.120	H5	C2	H6	119.439

All results from a given calculation for CH₂CHF (Ethene, fluoro-)

using model chemistry: SVWN/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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Number	Element	Mulliken
1	C	0.065
2	C	-0.340
3	F	-0.168
4	H	0.134
5	H	0.157
6	H	0.152

	x	y	z	Total
	0.972	0.767	0.000	1.238
CHELPG
AIM
ESP

	x	y	z
x	4.622	-0.536	0.000
y	-0.536	3.502	0.000
z	0.000	0.000	1.936

<r²>	42.749
(<r²>)^1/2	6.538

All results from a given calculation for CH2CHF (Ethene, fluoro-)

using model chemistry: SVWN/6-311G**

States and conformations

All results from a given calculation for CH₂CHF (Ethene, fluoro-)