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	hartrees
Energy at 0K	-78.546457
Energy at 298.15K	-78.549604
HF Energy	-78.546457
Nuclear repulsion energy	33.088805

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_g	3095	3095	0.00	233.95	0.11	0.19
2	A_g	1645	1645	0.00	32.72	0.01	0.03
3	A_g	1346	1346	0.00	39.22	0.24	0.38
4	A_u	1026	1026	0.00	0.00	0.00	0.00
5	B_1u	3080	3080	24.29	0.00	0.00	0.00
6	B_1u	1431	1431	7.59	0.00	0.00	0.00
7	B_2g	943	943	0.00	2.81	0.75	0.86
8	B_2u	3190	3190	32.86	0.00	0.00	0.00
9	B_2u	811	811	0.04	0.00	0.00	0.00
10	B_3g	3160	3160	0.00	132.50	0.75	0.86
11	B_3g	1205	1205	0.00	0.05	0.75	0.86
12	B_3u	953	953	96.03	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.671
C2	0.000	-0.671
H3	0.932	1.246
H4	-0.932	1.246
H5	-0.932	-1.246
H6	0.932	-1.246

	C1	C2	H3	H4	H5	H6
C1		1.3414	1.0953	1.0953	2.1312	2.1312
C2	1.3414		2.1312	2.1312	1.0953	1.0953
H3	1.0953	2.1312		1.8641	3.1119	2.4918
H4	1.0953	2.1312	1.8641		2.4918	3.1119
H5	2.1312	1.0953	3.1119	2.4918		1.8641
H6	2.1312	1.0953	2.4918	3.1119	1.8641

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.679	C1	C2	H6	121.679
C2	C1	H3	121.679	C2	C1	H4	121.679
H3	C1	H4	116.641	H5	C2	H6	116.641

All results from a given calculation for C₂H₄ (Ethylene)

using model chemistry: B97D3/aug-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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Number	Element	Mulliken
1	C	0.825
2	C	0.825
3	H	-0.412
4	H	-0.412
5	H	-0.412
6	H	-0.412

<r²>	23.557
(<r²>)^1/2	4.854

All results from a given calculation for C2H4 (Ethylene)

using model chemistry: B97D3/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₂H₄ (Ethylene)