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	hartrees
Energy at 0K	-153.450340
Energy at 298.15K
HF Energy	-152.925898
Nuclear repulsion energy	76.109468

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3212	2961	13.54
2	A₁	1614	1488	3.31
3	A₁	1370	1263	16.53
4	A₁	1226	1130	0.78
5	A₁	955	881	77.29
6	A₂	3292	3034	0.00
7	A₂	1223	1128	0.00
8	A₂	1105	1019	0.00
9	B₁	3307	3048	32.96
10	B₁	1233	1136	6.05
11	B₁	849	782	0.32
12	B₂	3201	2951	30.62
13	B₂	1567	1445	0.13
14	B₂	1230	1134	0.06
15	B₂	932	859	9.59

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.840
C2	0.000	0.727	-0.367
C3	0.000	-0.727	-0.367
H4	0.912	1.259	-0.581
H5	-0.912	1.259	-0.581
H6	-0.912	-1.259	-0.581
H7	0.912	-1.259	-0.581

	O1	C2	C3	H4	H5	H6	H7
O1		1.4089	1.4089	2.1061	2.1061	2.1061	2.1061
C2	1.4089		1.4541	1.0775	1.0775	2.1958	2.1958
C3	1.4089	1.4541		2.1958	2.1958	1.0775	1.0775
H4	2.1061	1.0775	2.1958		1.8249	3.1093	2.5174
H5	2.1061	1.0775	2.1958	1.8249		2.5174	3.1093
H6	2.1061	2.1958	1.0775	3.1093	2.5174		1.8249
H7	2.1061	2.1958	1.0775	2.5174	3.1093	1.8249

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	58.932	O1	C2	H4	115.135
O1	C2	H5	115.135	O1	C3	C2	58.932
O1	C3	H6	115.135	O1	C3	H7	115.135
C2	O1	C3	62.135	C2	C3	H6	119.565
C2	C3	H7	119.565	C3	C2	H4	119.565
C3	C2	H5	119.565	H4	C2	H5	115.734
H6	C3	H7	115.734

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

using model chemistry: CISD/6-311+G(3df,2p)

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: CISD/6-311+G(3df,2p)

States and conformations

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