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	hartrees
Energy at 0K	-151.081121
Energy at 298.15K
HF Energy	-150.924460
Nuclear repulsion energy	73.225091

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	3411	2974	0.03	63.70	0.11	0.19
2	A₁	1697	1479	0.17	13.92	0.72	0.84
3	A₁	1391	1213	0.48	12.99	0.29	0.46
4	A₁	1275	1111	2.74	2.86	0.25	0.40
5	A₁	997	870	3.90	7.23	0.75	0.85
6	A₂	3553	3098	0.00	46.77	0.75	0.86
7	A₂	1260	1099	0.00	6.58	0.75	0.86
8	A₂	1091	951	0.00	0.02	0.75	0.86
9	B₁	3561	3104	4.85	7.25	0.75	0.86
10	B₁	1203	1049	8.35	11.12	0.75	0.86
11	B₁	882	769	0.18	3.64	0.75	0.86
12	B₂	3400	2964	1.39	4.18	0.75	0.86
13	B₂	1657	1445	1.55	5.16	0.75	0.86
14	B₂	1230	1072	0.11	0.41	0.75	0.86
15	B₂	1069	932	0.02	5.62	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.886
C2	0.000	0.753	-0.380
C3	0.000	-0.753	-0.380
H4	0.930	1.295	-0.631
H5	-0.930	1.295	-0.631
H6	-0.930	-1.295	-0.631
H7	0.930	-1.295	-0.631

	O1	C2	C3	H4	H5	H6	H7
O1		1.4737	1.4737	2.2010	2.2010	2.2010	2.2010
C2	1.4737		1.5061	1.1054	1.1054	2.2634	2.2634
C3	1.4737	1.5061		2.2634	2.2634	1.1054	1.1054
H4	2.2010	1.1054	2.2634		1.8604	3.1891	2.5902
H5	2.2010	1.1054	2.2634	1.8604		2.5902	3.1891
H6	2.2010	2.2634	1.1054	3.1891	2.5902		1.8604
H7	2.2010	2.2634	1.1054	2.5902	3.1891	1.8604

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.269	O1	C2	H4	116.446
O1	C2	H5	116.446	O1	C3	C2	59.269
O1	C3	H6	116.446	O1	C3	H7	116.446
C2	O1	C3	61.462	C2	C3	H6	119.367
C2	C3	H7	119.367	C3	C2	H4	119.367
C3	C2	H5	119.367	H4	C2	H5	114.604
H6	C3	H7	114.604

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

using model chemistry: MP2/STO-3G

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: MP2/STO-3G

States and conformations

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