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	hartrees
Energy at 0K	-176.932701
Energy at 298.15K
HF Energy	-176.932701
Nuclear repulsion energy	68.331163

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'	3409	3097	7.46	35.45	0.59	0.74
2	A'	3377	3068	6.91	100.87	0.36	0.52
3	A'	3311	3008	0.41	66.51	0.19	0.32
4	A'	1865	1695	125.33	37.31	0.11	0.20
5	A'	1533	1392	6.51	4.26	0.48	0.65
6	A'	1437	1306	2.35	20.29	0.50	0.66
7	A'	1271	1155	126.46	1.98	0.17	0.29
8	A'	1023	929	53.88	5.14	0.35	0.52
9	A'	524	476	5.71	1.99	0.69	0.82
10	A"	1085	986	20.88	4.00	0.75	0.86
11	A"	1020	926	77.22	3.83	0.75	0.86
12	A"	800	727	0.79	4.64	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.427
C2	1.172	-0.152
F3	-1.131	-0.263
H4	-0.173	1.486
H5	1.266	-1.222
H6	2.060	0.450

	C1	C2	F3	H4	H5	H6
C1		1.3071	1.3252	1.0731	2.0791	2.0600
C2	1.3071		2.3059	2.1194	1.0743	1.0729
F3	1.3252	2.3059		1.9948	2.5821	3.2699
H4	1.0731	2.1194	1.9948		3.0668	2.4613
H5	2.0791	1.0743	2.5821	3.0668		1.8512
H6	2.0600	1.0729	3.2699	2.4613	1.8512

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.324	C1	C2	H6	119.560
C2	C1	F3	122.318	C2	C1	H4	125.559
F3	C1	H4	112.123	H5	C2	H6	119.116

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

using model chemistry: HF/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	0.216
2	C	-0.287
3	F	-0.289
4	H	0.108
5	H	0.131
6	H	0.121

	x	y	z	Total
	1.272	0.966	0.000	1.597
CHELPG
AIM
ESP

	x	y	z
x	4.411	-0.687	0.000
y	-0.687	3.208	0.000
z	0.000	0.000	1.864

<r²>	42.213
(<r²>)^1/2	6.497

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

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

States and conformations

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