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	hartrees
Energy at 0K	-153.557307
Energy at 298.15K
HF Energy	-152.927854
Nuclear repulsion energy	75.054622

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3115	3011
2	A₁	1540	1489
3	A₁	1293	1250
4	A₁	1149	1111
5	A₁	891	862
6	A₂	3194	3088
7	A₂	1170	1131
8	A₂	1045	1011
9	B₁	3209	3103
10	B₁	1164	1126
11	B₁	812	785
12	B₂	3107	3003
13	B₂	1504	1454
14	B₂	1159	1121
15	B₂	837	809

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.859
C2	0.000	0.734	-0.376
C3	0.000	-0.734	-0.376
H4	0.921	1.266	-0.590
H5	-0.921	1.266	-0.590
H6	-0.921	-1.266	-0.590
H7	0.921	-1.266	-0.590

	O1	C2	C3	H4	H5	H6	H7
O1		1.4365	1.4365	2.1328	2.1328	2.1328	2.1328
C2	1.4365		1.4685	1.0849	1.0849	2.2126	2.2126
C3	1.4365	1.4685		2.2126	2.2126	1.0849	1.0849
H4	2.1328	1.0849	2.2126		1.8424	3.1314	2.5321
H5	2.1328	1.0849	2.2126	1.8424		2.5321	3.1314
H6	2.1328	2.2126	1.0849	3.1314	2.5321		1.8424
H7	2.1328	2.2126	1.0849	2.5321	3.1314	1.8424

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.260	O1	C2	H4	114.822
O1	C2	H5	114.822	O1	C3	C2	59.260
O1	C3	H6	114.822	O1	C3	H7	114.822
C2	O1	C3	61.481	C2	C3	H6	119.351
C2	C3	H7	119.351	C3	C2	H4	119.351
C3	C2	H5	119.351	H4	C2	H5	116.227
H6	C3	H7	116.227

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

using model chemistry: QCISD(T)/aug-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: QCISD(T)/aug-cc-pVTZ

States and conformations

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