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	hartrees
Energy at 0K	-78.621472
Energy at 298.15K	-78.624650
HF Energy	-78.621472
Nuclear repulsion energy	33.434334

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	3136	3136	0.00	203.72	0.12	0.21
2	A_g	1685	1685	0.00	31.53	0.02	0.03
3	A_g	1384	1384	0.00	40.72	0.23	0.38
4	A_u	1069	1069	0.00	0.00	0.00	0.00
5	B_1u	3120	3120	19.06	0.00	0.00	0.00
6	B_1u	1483	1483	8.99	0.00	0.00	0.00
7	B_2g	977	977	0.00	3.12	0.75	0.86
8	B_2u	3220	3220	24.87	0.00	0.00	0.00
9	B_2u	823	823	0.05	0.00	0.00	0.00
10	B_3g	3191	3191	0.00	124.74	0.75	0.86
11	B_3g	1247	1247	0.00	0.25	0.75	0.86
12	B_3u	985	985	99.61	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.664
C2	0.000	-0.664
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		1.3274	1.0840	1.0840	2.1098	2.1098
C2	1.3274		2.1098	2.1098	1.0840	1.0840
H3	1.0840	2.1098		1.8435	3.0807	2.4682
H4	1.0840	2.1098	1.8435		2.4682	3.0807
H5	2.1098	1.0840	3.0807	2.4682		1.8435
H6	2.1098	1.0840	2.4682	3.0807	1.8435

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.752	C1	C2	H6	121.752
C2	C1	H3	121.752	C2	C1	H4	121.752
H3	C1	H4	116.496	H5	C2	H6	116.496

All results from a given calculation for C₂H₄ (Ethylene)

using model chemistry: TPSSh/6-311+G(3df,2p)

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	-0.187
2	C	-0.187
3	H	0.094
4	H	0.094
5	H	0.094
6	H	0.094

<r²>	23.156
(<r²>)^1/2	4.812

All results from a given calculation for C2H4 (Ethylene)

using model chemistry: TPSSh/6-311+G(3df,2p)

States and conformations

All results from a given calculation for C₂H₄ (Ethylene)