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	hartrees
Energy at 0K	-177.376414
Energy at 298.15K
HF Energy	-176.894178
Nuclear repulsion energy	66.978327

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3308	3174	2.64
2	A'	3239	3108	9.38
3	A'	3199	3069	0.74
4	A'	1739	1669	87.72
5	A'	1423	1365	6.25
6	A'	1335	1281	1.33
7	A'	1188	1139	87.13
8	A'	949	911	33.95
9	A'	479	459	4.74
10	A"	967	928	29.13
11	A"	872	837	39.77
12	A"	730	700	0.50

Atom	x (Å)	y (Å)
C1	0.000	0.435
C2	1.197	-0.164
F3	-1.156	-0.259
H4	-0.162	1.519
H5	1.284	-1.255
H6	2.102	0.449

	C1	C2	F3	H4	H5	H6
C1		1.3382	1.3483	1.0958	2.1226	2.1017
C2	1.3382		2.3543	2.1627	1.0944	1.0933
F3	1.3483	2.3543		2.0371	2.6353	3.3337
H4	1.0958	2.1627	2.0371		3.1281	2.5036
H5	2.1226	1.0944	2.6353	3.1281		1.8901
H6	2.1017	1.0933	3.3337	2.5036	1.8901

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.188	C1	C2	H6	119.286
C2	C1	F3	122.409	C2	C1	H4	125.091
F3	C1	H4	112.500	H5	C2	H6	119.526

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

using model chemistry: QCISD/cc-pVDZ

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 CH2CHF (Ethene, fluoro-)

using model chemistry: QCISD/cc-pVDZ

States and conformations

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