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	hartrees
Energy at 0K	-78.485639
Energy at 298.15K	-78.488804
HF Energy	-78.485639
Nuclear repulsion energy	33.251925

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	3173	3051	0.00	211.85	0.12	0.22
2	A_g	1712	1646	0.00	11.99	0.05	0.10
3	A_g	1369	1316	0.00	33.90	0.44	0.61
4	A_u	1062	1022	0.00	0.00	0.00	0.00
5	B_1u	3154	3032	12.57	0.00	0.00	0.00
6	B_1u	1439	1384	8.82	0.00	0.00	0.00
7	B_2g	963	926	0.00	1.36	0.75	0.86
8	B_2u	3270	3144	16.54	0.00	0.00	0.00
9	B_2u	820	789	0.97	0.00	0.00	0.00
10	B_3g	3244	3119	0.00	137.78	0.75	0.86
11	B_3g	1225	1177	0.00	1.13	0.75	0.86
12	B_3u	971	933	82.32	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.665
C2	0.000	-0.665
H3	0.931	1.239
H4	-0.931	1.239
H5	-0.931	-1.239
H6	0.931	-1.239

	C1	C2	H3	H4	H5	H6
C1		1.3310	1.0937	1.0937	2.1201	2.1201
C2	1.3310		2.1201	2.1201	1.0937	1.0937
H3	1.0937	2.1201		1.8624	3.1001	2.4783
H4	1.0937	2.1201	1.8624		2.4783	3.1001
H5	2.1201	1.0937	3.1001	2.4783		1.8624
H6	2.1201	1.0937	2.4783	3.1001	1.8624

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.634	C1	C2	H6	121.634
C2	C1	H3	121.634	C2	C1	H4	121.634
H3	C1	H4	116.732	H5	C2	H6	116.732

All results from a given calculation for C₂H₄ (Ethylene)

using model chemistry: PBE1PBE/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	-0.097
2	C	-0.097
3	H	0.048
4	H	0.048
5	H	0.048
6	H	0.048

<r²>	23.152
(<r²>)^1/2	4.812

All results from a given calculation for C2H4 (Ethylene)

using model chemistry: PBE1PBE/cc-pVDZ

States and conformations

All results from a given calculation for C₂H₄ (Ethylene)