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	hartrees
Energy at 0K	-177.556605
Energy at 298.15K
HF Energy	-176.956607
Nuclear repulsion energy	67.679174

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3301	3159	1.37
2	A'	3245	3105	4.36
3	A'	3199	3061	0.95
4	A'	1743	1668	99.83
5	A'	1435	1373	6.48
6	A'	1349	1291	1.53
7	A'	1199	1147	95.46
8	A'	958	917	38.55
9	A'	488	467	4.40
10	A"	972	931	36.58
11	A"	905	866	40.66
12	A"	736	704	3.37

Atom	x (Å)	y (Å)
C1	0.000	0.434
C2	1.183	-0.153
F3	-1.141	-0.269
H4	-0.177	1.500
H5	1.278	-1.228
H6	2.070	0.460

	C1	C2	F3	H4	H5	H6
C1		1.3210	1.3407	1.0800	2.0971	2.0705
C2	1.3210		2.3273	2.1405	1.0794	1.0784
F3	1.3407	2.3273		2.0147	2.6026	3.2933
H4	1.0800	2.1405	2.0147		3.0918	2.4762
H5	2.0971	1.0794	2.6026	3.0918		1.8648
H6	2.0705	1.0784	3.2933	2.4762	1.8648

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.455	C1	C2	H6	118.949
C2	C1	F3	121.947	C2	C1	H4	125.834
F3	C1	H4	112.219	H5	C2	H6	119.596

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

using model chemistry: CCD/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: CCD/aug-cc-pVTZ

States and conformations

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