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	hartrees
Energy at 0K	-153.677625
Energy at 298.15K
HF Energy	-153.515443
Nuclear repulsion energy	75.215471

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	3119	3119	12.00	217.55	0.09	0.17
2	A₁	1557	1557	2.74	1.89	0.73	0.85
3	A₁	1310	1310	12.48	25.46	0.15	0.26
4	A₁	1158	1158	0.02	1.75	0.43	0.60
5	A₁	896	896	64.97	10.82	0.75	0.85
6	A₂	3197	3197	0.00	115.01	0.75	0.86
7	A₂	1185	1185	0.00	2.86	0.75	0.86
8	A₂	1052	1052	0.00	0.06	0.75	0.86
9	B₁	3212	3212	56.91	17.45	0.75	0.86
10	B₁	1179	1179	4.27	10.76	0.75	0.86
11	B₁	826	826	0.00	6.17	0.75	0.86
12	B₂	3111	3111	39.58	10.00	0.75	0.86
13	B₂	1521	1521	0.07	6.05	0.75	0.86
14	B₂	1153	1153	2.86	2.02	0.75	0.86
15	B₂	846	846	10.18	4.26	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.855
C2	0.000	0.733	-0.373
C3	0.000	-0.733	-0.373
H4	0.919	1.267	-0.593
H5	-0.919	1.267	-0.593
H6	-0.919	-1.267	-0.593
H7	0.919	-1.267	-0.593

	O1	C2	C3	H4	H5	H6	H7
O1		1.4302	1.4302	2.1329	2.1329	2.1329	2.1329
C2	1.4302		1.4666	1.0858	1.0858	2.2128	2.2128
C3	1.4302	1.4666		2.2128	2.2128	1.0858	1.0858
H4	2.1329	1.0858	2.2128		1.8384	3.1314	2.5349
H5	2.1329	1.0858	2.2128	1.8384		2.5349	3.1314
H6	2.1329	2.2128	1.0858	3.1314	2.5349		1.8384
H7	2.1329	2.2128	1.0858	2.5349	3.1314	1.8384

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.155	O1	C2	H4	115.248
O1	C2	H5	115.248	O1	C3	C2	59.155
O1	C3	H6	115.248	O1	C3	H7	115.248
C2	O1	C3	61.689	C2	C3	H6	119.471
C2	C3	H7	119.471	C3	C2	H4	119.471
C3	C2	H5	119.471	H4	C2	H5	115.690
H6	C3	H7	115.690

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

using model chemistry: B2PLYP/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	-0.315
2	C	-0.074
3	C	-0.074
4	H	0.116
5	H	0.116
6	H	0.116
7	H	0.116

	x	y	z	Total
	0.000	0.000	-1.979	1.979
CHELPG
AIM
ESP

<r²>	36.553
(<r²>)^1/2	6.046

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

using model chemistry: B2PLYP/6-311G**

States and conformations

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