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	hartrees
Energy at 0K	-78.624142
Energy at 298.15K	-78.627318
HF Energy	-78.624142
Nuclear repulsion energy	33.490416

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	3139	3139	0.00	216.74	0.11	0.19
2	A_g	1689	1689	0.00	33.99	0.01	0.02
3	A_g	1380	1380	0.00	43.19	0.20	0.33
4	A_u	1064	1064	0.00	0.00	0.00	0.00
5	B_1u	3126	3126	16.48	0.00	0.00	0.00
6	B_1u	1479	1479	9.55	0.00	0.00	0.00
7	B_2g	985	985	0.00	3.18	0.75	0.86
8	B_2u	3223	3223	20.30	0.00	0.00	0.00
9	B_2u	835	835	0.04	0.00	0.00	0.00
10	B_3g	3194	3194	0.00	123.25	0.75	0.86
11	B_3g	1246	1246	0.00	0.07	0.75	0.86
12	B_3u	979	979	96.73	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.662
C2	0.000	-0.662
H3	0.921	1.232
H4	-0.921	1.232
H5	-0.921	-1.232
H6	0.921	-1.232

	C1	C2	H3	H4	H5	H6
C1		1.3249	1.0824	1.0824	2.1061	2.1061
C2	1.3249		2.1061	2.1061	1.0824	1.0824
H3	1.0824	2.1061		1.8414	3.0755	2.4634
H4	1.0824	2.1061	1.8414		2.4634	3.0755
H5	2.1061	1.0824	3.0755	2.4634		1.8414
H6	2.1061	1.0824	2.4634	3.0755	1.8414

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.728	C1	C2	H6	121.728
C2	C1	H3	121.728	C2	C1	H4	121.728
H3	C1	H4	116.544	H5	C2	H6	116.544

All results from a given calculation for C₂H₄ (Ethylene)

using model chemistry: B3LYP/daug-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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Number	Element	Mulliken
1	C	-0.972
2	C	-0.972
3	H	0.486
4	H	0.486
5	H	0.486
6	H	0.486

<r²>	23.199
(<r²>)^1/2	4.816

All results from a given calculation for C2H4 (Ethylene)

using model chemistry: B3LYP/daug-cc-pVTZ

States and conformations

All results from a given calculation for C₂H₄ (Ethylene)