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	hartrees
Energy at 0K	-153.564934
Energy at 298.15K
HF Energy	-152.926678
Nuclear repulsion energy	75.765121

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3162	2998	12.12
2	A₁	1583	1500	2.53
3	A₁	1336	1267	13.26
4	A₁	1192	1130	0.19
5	A₁	929	881	64.34
6	A₂	3220	3053
7	A₂	1196	1134
8	A₂	1078	1022
9	B₁	3236	3068	38.86
10	B₁	1206	1143	4.46
11	B₁	832	789	0.02
12	B₂	3151	2988	33.27
13	B₂	1541	1461	0.00
14	B₂	1189	1128	1.06
15	B₂	890	844	8.90

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.848
C2	0.000	0.729	-0.369
C3	0.000	-0.729	-0.369
H4	0.914	1.257	-0.589
H5	-0.914	1.257	-0.589
H6	-0.914	-1.257	-0.589
H7	0.914	-1.257	-0.589

	O1	C2	C3	H4	H5	H6	H7
O1		1.4185	1.4185	2.1167	2.1167	2.1167	2.1167
C2	1.4185		1.4589	1.0785	1.0785	2.1981	2.1981
C3	1.4185	1.4589		2.1981	2.1981	1.0785	1.0785
H4	2.1167	1.0785	2.1981		1.8288	3.1093	2.5147
H5	2.1167	1.0785	2.1981	1.8288		2.5147	3.1093
H6	2.1167	2.1981	1.0785	3.1093	2.5147		1.8288
H7	2.1167	2.1981	1.0785	2.5147	3.1093	1.8288

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.054	O1	C2	H4	115.252
O1	C2	H5	115.252	O1	C3	C2	59.054
O1	C3	H6	115.252	O1	C3	H7	115.252
C2	O1	C3	61.891	C2	C3	H6	119.307
C2	C3	H7	119.307	C3	C2	H4	119.307
C3	C2	H5	119.307	H4	C2	H5	115.953
H6	C3	H7	115.953

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

using model chemistry: CCSD=FULL/cc-pVTZ

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

using model chemistry: CCSD=FULL/cc-pVTZ

States and conformations

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