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	hartrees
Energy at 0K	-153.756586
Energy at 298.15K
HF Energy	-153.756586
Nuclear repulsion energy	75.669529

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	3142	3142	10.26	195.96	0.10	0.19
2	A₁	1570	1570	3.77	1.81	0.33	0.49
3	A₁	1339	1339	19.04	26.51	0.17	0.29
4	A₁	1171	1171	0.02	0.36	0.70	0.82
5	A₁	936	936	71.42	11.25	0.72	0.84
6	A₂	3224	3224	0.00	102.07	0.75	0.86
7	A₂	1185	1185	0.00	3.31	0.75	0.86
8	A₂	1063	1063	0.00	0.18	0.75	0.86
9	B₁	3237	3237	48.58	13.70	0.75	0.86
10	B₁	1197	1197	5.47	11.02	0.75	0.86
11	B₁	824	824	0.06	5.56	0.75	0.86
12	B₂	3134	3134	35.04	8.71	0.75	0.86
13	B₂	1522	1522	0.00	5.41	0.75	0.86
14	B₂	1150	1150	1.78	1.91	0.75	0.86
15	B₂	928	928	9.35	4.80	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.842
C2	0.000	0.733	-0.367
C3	0.000	-0.733	-0.367
H4	0.921	1.266	-0.583
H5	-0.921	1.266	-0.583
H6	-0.921	-1.266	-0.583
H7	0.921	-1.266	-0.583

	O1	C2	C3	H4	H5	H6	H7
O1		1.4145	1.4145	2.1176	2.1176	2.1176	2.1176
C2	1.4145		1.4668	1.0856	1.0856	2.2122	2.2122
C3	1.4145	1.4668		2.2122	2.2122	1.0856	1.0856
H4	2.1176	1.0856	2.2122		1.8412	3.1314	2.5330
H5	2.1176	1.0856	2.2122	1.8412		2.5330	3.1314
H6	2.1176	2.2122	1.0856	3.1314	2.5330		1.8412
H7	2.1176	2.2122	1.0856	2.5330	3.1314	1.8412

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	58.768	O1	C2	H4	115.147
O1	C2	H5	115.147	O1	C3	C2	58.768
O1	C3	H6	115.147	O1	C3	H7	115.147
C2	O1	C3	62.463	C2	C3	H6	119.410
C2	C3	H7	119.410	C3	C2	H4	119.410
C3	C2	H5	119.410	H4	C2	H5	116.000
H6	C3	H7	116.000

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

using model chemistry: M06-2X/6-311G*

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	-0.292
2	C	-0.309
3	C	-0.309
4	H	0.228
5	H	0.228
6	H	0.228
7	H	0.228

	x	y	z	Total
	0.000	0.000	-1.994	1.994
CHELPG
AIM
ESP

<r²>	36.244
(<r²>)^1/2	6.020

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

using model chemistry: M06-2X/6-311G*

States and conformations

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