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	hartrees
Energy at 0K	-29.592980
Energy at 298.15K	-29.597645
Nuclear repulsion energy	42.222084

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3131	2997	20.95
2	A₁	1547	1481	5.09
3	A₁	1320	1263	12.58
4	A₁	1153	1104	0.17
5	A₁	930	890	79.29
6	A₂	3206	3069	0.00
7	A₂	1144	1095	0.00
8	A₂	1032	987	0.00
9	B₁	3224	3086	79.87
10	B₁	1160	1110	2.63
11	B₁	801	767	0.59
12	B₂	3121	2987	52.96
13	B₂	1487	1424	0.09
14	B₂	1123	1075	2.08
15	B₂	918	879	11.91

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.849
C2	0.000	0.744	-0.369
C3	0.000	-0.744	-0.369
H4	0.929	1.285	-0.590
H5	-0.929	1.285	-0.590
H6	-0.929	-1.285	-0.590
H7	0.929	-1.285	-0.590

	O1	C2	C3	H4	H5	H6	H7
O1		1.4276	1.4276	2.1411	2.1411	2.1411	2.1411
C2	1.4276		1.4879	1.0973	1.0973	2.2423	2.2423
C3	1.4276	1.4879		2.2423	2.2423	1.0973	1.0973
H4	2.1411	1.0973	2.2423		1.8576	3.1711	2.5700
H5	2.1411	1.0973	2.2423	1.8576		2.5700	3.1711
H6	2.1411	2.2423	1.0973	3.1711	2.5700		1.8576
H7	2.1411	2.2423	1.0973	2.5700	3.1711	1.8576

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	58.593	O1	C2	H4	115.367
O1	C2	H5	115.367	O1	C3	C2	58.593
O1	C3	H6	115.367	O1	C3	H7	115.367
C2	O1	C3	62.815	C2	C3	H6	119.543
C2	C3	H7	119.543	C3	C2	H4	119.543
C3	C2	H5	119.543	H4	C2	H5	115.661
H6	C3	H7	115.661

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

using model chemistry: B1B95/CEP-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	-0.186
2	C	-0.265
3	C	-0.265
4	H	0.179
5	H	0.179
6	H	0.179
7	H	0.179

	x	y	z	Total
	0.000	0.000	-2.054	2.054
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B1B95/CEP-31G*

States and conformations

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