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	hartrees
Energy at 0K	-153.622402
Energy at 298.15K
HF Energy	-153.474162
Nuclear repulsion energy	75.122265

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	3150	2987	11.30	188.48	0.10	0.18
2	A₁	1588	1506	3.33	3.99	0.75	0.86
3	A₁	1322	1254	9.87	22.40	0.16	0.27
4	A₁	1177	1116	0.06	3.13	0.41	0.58
5	A₁	908	862	57.95	11.47	0.75	0.86
6	A₂	3225	3059	0.00	105.15	0.75	0.86
7	A₂	1204	1142	0.00	5.11	0.75	0.86
8	A₂	1058	1003	0.00	0.14	0.75	0.86
9	B₁	3240	3073	56.81	14.58	0.75	0.86
10	B₁	1184	1123	2.70	15.39	0.75	0.86
11	B₁	832	789	0.07	9.17	0.75	0.86
12	B₂	3142	2980	37.02	9.30	0.75	0.86
13	B₂	1550	1470	1.04	6.72	0.75	0.86
14	B₂	1161	1101	2.22	3.84	0.75	0.86
15	B₂	861	816	11.78	4.82	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.857
C2	0.000	0.733	-0.374
C3	0.000	-0.733	-0.374
H4	0.919	1.271	-0.594
H5	-0.919	1.271	-0.594
H6	-0.919	-1.271	-0.594
H7	0.919	-1.271	-0.594

	O1	C2	C3	H4	H5	H6	H7
O1		1.4325	1.4325	2.1371	2.1371	2.1371	2.1371
C2	1.4325		1.4657	1.0876	1.0876	2.2158	2.2158
C3	1.4325	1.4657		2.2158	2.2158	1.0876	1.0876
H4	2.1371	1.0876	2.2158		1.8377	3.1373	2.5427
H5	2.1371	1.0876	2.2158	1.8377		2.5427	3.1373
H6	2.1371	2.2158	1.0876	3.1373	2.5427		1.8377
H7	2.1371	2.2158	1.0876	2.5427	3.1373	1.8377

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.231	O1	C2	H4	115.307
O1	C2	H5	115.307	O1	C3	C2	59.231
O1	C3	H6	115.307	O1	C3	H7	115.307
C2	O1	C3	61.538	C2	C3	H6	119.679
C2	C3	H7	119.679	C3	C2	H4	119.679
C3	C2	H5	119.679	H4	C2	H5	115.310
H6	C3	H7	115.310

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

using model chemistry: B2PLYP=FULL/6-31G*

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: B2PLYP=FULL/6-31G*

States and conformations

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