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	hartrees
Energy at 0K	-153.721153
Energy at 298.15K
HF Energy	-153.721153
Nuclear repulsion energy	75.579291

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3140	2984	9.83	200.82	0.10	0.18
2	A₁	1572	1494	4.91	3.25	0.63	0.77
3	A₁	1343	1276	16.55	25.98	0.19	0.31
4	A₁	1179	1120	0.07	1.04	0.53	0.69
5	A₁	943	896	58.39	12.62	0.73	0.84
6	A₂	3221	3061	0.00	109.70	0.75	0.86
7	A₂	1179	1120	0.00	5.15	0.75	0.86
8	A₂	1056	1004	0.00	0.30	0.75	0.86
9	B₁	3234	3074	48.24	14.60	0.75	0.86
10	B₁	1188	1129	4.15	15.38	0.75	0.86
11	B₁	819	779	0.06	8.32	0.75	0.86
12	B₂	3132	2977	30.23	9.03	0.75	0.86
13	B₂	1519	1444	0.46	6.85	0.75	0.86
14	B₂	1155	1097	1.22	3.47	0.75	0.86
15	B₂	944	897	10.82	4.98	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.844
C2	0.000	0.734	-0.366
C3	0.000	-0.734	-0.366
H4	0.921	1.268	-0.589
H5	-0.921	1.268	-0.589
H6	-0.921	-1.268	-0.589
H7	0.921	-1.268	-0.589

	O1	C2	C3	H4	H5	H6	H7
O1		1.4155	1.4155	2.1237	2.1237	2.1237	2.1237
C2	1.4155		1.4681	1.0877	1.0877	2.2149	2.2149
C3	1.4155	1.4681		2.2149	2.2149	1.0877	1.0877
H4	2.1237	1.0877	2.2149		1.8422	3.1342	2.5357
H5	2.1237	1.0877	2.2149	1.8422		2.5357	3.1342
H6	2.1237	2.2149	1.0877	3.1342	2.5357		1.8422
H7	2.1237	2.2149	1.0877	2.5357	3.1342	1.8422

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	58.764	O1	C2	H4	115.450
O1	C2	H5	115.450	O1	C3	C2	58.764
O1	C3	H6	115.450	O1	C3	H7	115.450
C2	O1	C3	62.472	C2	C3	H6	119.392
C2	C3	H7	119.392	C3	C2	H4	119.392
C3	C2	H5	119.392	H4	C2	H5	115.738
H6	C3	H7	115.738

All results from a given calculation for C₂H₄O (Ethylene oxide)

using model chemistry: M06-2X/6-31G**

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	O	-0.452
2	C	-0.041
3	C	-0.041
4	H	0.134
5	H	0.134
6	H	0.134
7	H	0.134

	x	y	z	Total
	0.000	0.000	-1.977	1.977
CHELPG
AIM
ESP

<r²>	36.198
(<r²>)^1/2	6.016

All results from a given calculation for C2H4O (Ethylene oxide)

using model chemistry: M06-2X/6-31G**

States and conformations

All results from a given calculation for C₂H₄O (Ethylene oxide)