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	hartrees
Energy at 0K	-153.730370
Energy at 298.15K
HF Energy	-153.730370
Nuclear repulsion energy	75.346026

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3119	2984	12.77
2	A₁	1572	1504	4.16
3	A₁	1327	1270	12.97
4	A₁	1168	1118	0.06
5	A₁	924	884	60.30
6	A₂	3191	3053	0.00
7	A₂	1187	1135	0.00
8	A₂	1048	1003	0.00
9	B₁	3207	3068	61.64
10	B₁	1179	1128	2.54
11	B₁	824	788	0.05
12	B₂	3110	2975	41.58
13	B₂	1527	1461	0.66
14	B₂	1146	1096	2.27
15	B₂	891	853	13.56

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.850
C2	0.000	0.733	-0.369
C3	0.000	-0.733	-0.369
H4	0.921	1.272	-0.592
H5	-0.921	1.272	-0.592
H6	-0.921	-1.272	-0.592
H7	0.921	-1.272	-0.592

	O1	C2	C3	H4	H5	H6	H7
O1		1.4228	1.4228	2.1327	2.1327	2.1327	2.1327
C2	1.4228		1.4653	1.0906	1.0906	2.2176	2.2176
C3	1.4228	1.4653		2.2176	2.2176	1.0906	1.0906
H4	2.1327	1.0906	2.2176		1.8423	3.1413	2.5444
H5	2.1327	1.0906	2.2176	1.8423		2.5444	3.1413
H6	2.1327	2.2176	1.0906	3.1413	2.5444		1.8423
H7	2.1327	2.2176	1.0906	2.5444	3.1413	1.8423

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.007	O1	C2	H4	115.468
O1	C2	H5	115.468	O1	C3	C2	59.007
O1	C3	H6	115.468	O1	C3	H7	115.468
C2	O1	C3	61.986	C2	C3	H6	119.652
C2	C3	H7	119.652	C3	C2	H4	119.652
C3	C2	H5	119.652	H4	C2	H5	115.271
H6	C3	H7	115.271

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

using model chemistry: B3PW91/6-31G*

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	-0.421
2	C	-0.140
3	C	-0.140
4	H	0.175
5	H	0.175
6	H	0.175
7	H	0.175

	x	y	z	Total
	0.000	0.000	-1.946	1.946
CHELPG
AIM
ESP	0.023	0.000	-1.993	1.993

<r²>	36.283
(<r²>)^1/2	6.024

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

using model chemistry: B3PW91/6-31G*

States and conformations

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