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	hartrees
Energy at 0K	-78.471011
Energy at 298.15K	-78.474135
HF Energy	-78.471011
Nuclear repulsion energy	33.010318

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	3081	3063	0.00	224.69	0.12	0.21
2	A_g	1649	1639	0.00	8.59	0.04	0.07
3	A_g	1326	1319	0.00	33.80	0.45	0.62
4	A_u	1029	1023	0.00	0.00	0.00	0.00
5	B_1u	3064	3046	15.37	0.00	0.00	0.00
6	B_1u	1393	1385	6.33	0.00	0.00	0.00
7	B_2g	912	907	0.00	0.49	0.75	0.86
8	B_2u	3177	3158	21.24	0.00	0.00	0.00
9	B_2u	796	792	1.03	0.00	0.00	0.00
10	B_3g	3149	3131	0.00	146.78	0.75	0.86
11	B_3g	1187	1180	0.00	1.30	0.75	0.86
12	B_3u	931	925	72.36	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.670
C2	0.000	-0.670
H3	0.938	1.249
H4	-0.938	1.249
H5	-0.938	-1.249
H6	0.938	-1.249

	C1	C2	H3	H4	H5	H6
C1		1.3408	1.1016	1.1016	2.1359	2.1359
C2	1.3408		2.1359	2.1359	1.1016	1.1016
H3	1.1016	2.1359		1.8753	3.1231	2.4974
H4	1.1016	2.1359	1.8753		2.4974	3.1231
H5	2.1359	1.1016	3.1231	2.4974		1.8753
H6	2.1359	1.1016	2.4974	3.1231	1.8753

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.666	C1	C2	H6	121.666
C2	C1	H3	121.666	C2	C1	H4	121.666
H3	C1	H4	116.669	H5	C2	H6	116.669

All results from a given calculation for C₂H₄ (Ethylene)

using model chemistry: PBEPBE/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	-0.066
2	C	-0.066
3	H	0.033
4	H	0.033
5	H	0.033
6	H	0.033

<r²>	23.423
(<r²>)^1/2	4.840

All results from a given calculation for C2H4 (Ethylene)

using model chemistry: PBEPBE/cc-pVDZ

States and conformations

All results from a given calculation for C₂H₄ (Ethylene)