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	hartrees
Energy at 0K	-177.636963
Energy at 298.15K
HF Energy	-176.956400
Nuclear repulsion energy	67.563519

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3268	3268
2	A'	3230	3230
3	A'	3184	3184
4	A'	1705	1705
5	A'	1416	1416
6	A'	1326	1326
7	A'	1173	1173
8	A'	936	936
9	A'	475	475
10	A"	948	948
11	A"	874	874
12	A"	722	722

Atom	x (Å)	y (Å)
C1	0.000	0.435
C2	1.187	-0.151
F3	-1.144	-0.272
H4	-0.179	1.498
H5	1.283	-1.224
H6	2.068	0.467

	C1	C2	F3	H4	H5	H6
C1		1.3236	1.3449	1.0776	2.0974	2.0686
C2	1.3236		2.3335	2.1409	1.0774	1.0767
F3	1.3449	2.3335		2.0162	2.6066	3.2961
H4	1.0776	2.1409	2.0162		3.0896	2.4725
H5	2.0974	1.0774	2.6066	3.0896		1.8644
H6	2.0686	1.0767	3.2961	2.4725	1.8644

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.421	C1	C2	H6	118.689
C2	C1	F3	121.961	C2	C1	H4	125.847
F3	C1	H4	112.192	H5	C2	H6	119.890

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

using model chemistry: QCISD(T)=FULL/aug-cc-pVTZ

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(T)=FULL/aug-cc-pVTZ

States and conformations

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