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	hartrees
Energy at 0K	-153.541543
Energy at 298.15K
HF Energy	-152.924198
Nuclear repulsion energy	75.200335

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3112	2968
2	A₁	1545	1474
3	A₁	1300	1240
4	A₁	1156	1103
5	A₁	898	856
6	A₂	3194	3046
7	A₂	1175	1121
8	A₂	1054	1005
9	B₁	3208	3060
10	B₁	1175	1120
11	B₁	815	778
12	B₂	3104	2960
13	B₂	1508	1438
14	B₂	1166	1112
15	B₂	848	809

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.855
C2	0.000	0.734	-0.374
C3	0.000	-0.734	-0.374
H4	0.921	1.267	-0.588
H5	-0.921	1.267	-0.588
H6	-0.921	-1.267	-0.588
H7	0.921	-1.267	-0.588

	O1	C2	C3	H4	H5	H6	H7
O1		1.4313	1.4313	2.1299	2.1299	2.1299	2.1299
C2	1.4313		1.4671	1.0855	1.0855	2.2128	2.2128
C3	1.4313	1.4671		2.2128	2.2128	1.0855	1.0855
H4	2.1299	1.0855	2.2128		1.8414	3.1327	2.5343
H5	2.1299	1.0855	2.2128	1.8414		2.5343	3.1327
H6	2.1299	2.2128	1.0855	3.1327	2.5343		1.8414
H7	2.1299	2.2128	1.0855	2.5343	3.1327	1.8414

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.169	O1	C2	H4	114.923
O1	C2	H5	114.923	O1	C3	C2	59.169
O1	C3	H6	114.923	O1	C3	H7	114.923
C2	O1	C3	61.662	C2	C3	H6	119.444
C2	C3	H7	119.444	C3	C2	H4	119.444
C3	C2	H5	119.444	H4	C2	H5	116.027
H6	C3	H7	116.027

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

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

States and conformations

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