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	hartrees
Energy at 0K	-153.537089
Energy at 298.15K	-153.533005
HF Energy	-152.864875
Nuclear repulsion energy	76.332642

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	3288	3288	11.19	188.29	0.11	0.20
2	A₁	1691	1691	5.35	2.70	0.40	0.57
3	A₁	1422	1422	18.00	27.26	0.17	0.30
4	A₁	1293	1293	4.62	3.12	0.30	0.47
5	A₁	985	985	85.31	12.78	0.73	0.84
6	A₂	3362	3362	0.00	107.90	0.75	0.86
7	A₂	1280	1280	0.00	4.01	0.75	0.86
8	A₂	1152	1152	0.00	0.14	0.75	0.86
9	B₁	3379	3379	65.22	11.46	0.75	0.86
10	B₁	1289	1289	7.78	13.40	0.75	0.86
11	B₁	878	878	0.01	6.44	0.75	0.86
12	B₂	3274	3274	50.03	7.50	0.75	0.86
13	B₂	1636	1636	0.84	5.15	0.75	0.86
14	B₂	1279	1279	0.04	2.29	0.75	0.86
15	B₂	971	971	11.69	8.43	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.832
C2	0.000	0.727	-0.364
C3	0.000	-0.727	-0.364
H4	0.913	1.264	-0.574
H5	-0.913	1.264	-0.574
H6	-0.913	-1.264	-0.574
H7	0.913	-1.264	-0.574

	O1	C2	C3	H4	H5	H6	H7
O1		1.3996	1.3996	2.0997	2.0997	2.0997	2.0997
C2	1.3996		1.4544	1.0797	1.0797	2.2008	2.2008
C3	1.3996	1.4544		2.2008	2.2008	1.0797	1.0797
H4	2.0997	1.0797	2.2008		1.8252	3.1188	2.5289
H5	2.0997	1.0797	2.2008	1.8252		2.5289	3.1188
H6	2.0997	2.2008	1.0797	3.1188	2.5289		1.8252
H7	2.0997	2.2008	1.0797	2.5289	3.1188	1.8252

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	58.695	O1	C2	H4	115.146
O1	C2	H5	115.146	O1	C3	C2	58.695
O1	C3	H6	115.146	O1	C3	H7	115.146
C2	O1	C3	62.609	C2	C3	H6	119.841
C2	C3	H7	119.841	C3	C2	H4	119.841
C3	C2	H5	119.841	H4	C2	H5	115.403
H6	C3	H7	115.403

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

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

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