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	hartrees
Energy at 0K	-78.621544
Energy at 298.15K	-78.624725
HF Energy	-78.621544
Nuclear repulsion energy	33.455097

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	3143	3028	0.00	220.13	0.15	0.26
2	A_g	1693	1631	0.00	16.07	0.02	0.05
3	A_g	1385	1334	0.00	36.55	0.33	0.50
4	A_u	1063	1024	0.00	0.00	0.00	0.00
5	B_1u	3130	3015	17.01	0.00	0.00	0.00
6	B_1u	1479	1425	9.81	0.00	0.00	0.00
7	B_2g	982	946	0.00	1.28	0.75	0.86
8	B_2u	3228	3110	25.14	0.00	0.00	0.00
9	B_2u	840	809	0.74	0.00	0.00	0.00
10	B_3g	3200	3083	0.00	123.43	0.75	0.86
11	B_3g	1245	1200	0.00	0.48	0.75	0.86
12	B_3u	979	943	111.80	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.663
C2	0.000	-0.663
H3	0.922	1.234
H4	-0.922	1.234
H5	-0.922	-1.234
H6	0.922	-1.234

	C1	C2	H3	H4	H5	H6
C1		1.3259	1.0839	1.0839	2.1086	2.1086
C2	1.3259		2.1086	2.1086	1.0839	1.0839
H3	1.0839	2.1086		1.8431	3.0796	2.4672
H4	1.0839	2.1086	1.8431		2.4672	3.0796
H5	2.1086	1.0839	3.0796	2.4672		1.8431
H6	2.1086	1.0839	2.4672	3.0796	1.8431

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.769	C1	C2	H6	121.769
C2	C1	H3	121.769	C2	C1	H4	121.769
H3	C1	H4	116.462	H5	C2	H6	116.462

All results from a given calculation for C₂H₄ (Ethylene)

using model chemistry: B3LYPultrafine/TZVP

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	-0.227
2	C	-0.227
3	H	0.114
4	H	0.114
5	H	0.114
6	H	0.114

<r²>	23.205
(<r²>)^1/2	4.817

All results from a given calculation for C2H4 (Ethylene)

using model chemistry: B3LYPultrafine/TZVP

States and conformations

All results from a given calculation for C₂H₄ (Ethylene)