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	hartrees
Energy at 0K	-77.659100
Energy at 298.15K	-77.660603
HF Energy	-77.389766
Nuclear repulsion energy	28.199673

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3260	3260
2	A'	3197	3197
3	A'	3094	3094
4	A'	1643	1643
5	A'	1424	1424
6	A'	1095	1095
7	A'	755	755
8	A"	911	911
9	A"	797	797

Atom	x (Å)	y (Å)
C1	0.051	0.731
C2	0.051	-0.592
H3	-0.703	1.512
H4	-0.879	-1.172
H5	0.974	-1.172

	C1	C2	H3	H4	H5
C1		1.3233	1.0854	2.1183	2.1153
C2	1.3233		2.2353	1.0959	1.0905
H3	1.0854	2.2353		2.6902	3.1651
H4	2.1183	1.0959	2.6902		1.8535
H5	2.1153	1.0905	3.1651	1.8535

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	H4	121.955		C1	C2	H5	122.114
C2	C1	H3	136.030		H4	C2	H5	115.931

All results from a given calculation for C₂H₃ (vinyl)

using model chemistry: QCISD(TQ)=FULL/6-31G*

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 C2H3 (vinyl)

using model chemistry: QCISD(TQ)=FULL/6-31G*

States and conformations

All results from a given calculation for C₂H₃ (vinyl)