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	hartrees
Energy at 0K	-152.852474
Energy at 298.15K
HF Energy	-152.852474
Nuclear repulsion energy	73.503123

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	3189	3020	2.01	156.82	0.10	0.18
2	A₁	1578	1495	0.00	5.24	0.74	0.85
3	A₁	1255	1189	7.95	21.62	0.15	0.26
4	A₁	1159	1098	9.13	4.03	0.35	0.52
5	A₁	865	819	29.69	11.29	0.75	0.86
6	A₂	3268	3095	0.00	83.88	0.75	0.86
7	A₂	1201	1137	0.00	6.38	0.75	0.86
8	A₂	1015	961	0.00	0.01	0.75	0.86
9	B₁	3285	3111	25.32	10.47	0.75	0.86
10	B₁	1136	1076	1.63	18.72	0.75	0.86
11	B₁	847	803	0.00	9.58	0.75	0.86
12	B₂	3179	3011	13.09	6.33	0.75	0.86
13	B₂	1553	1471	0.01	5.18	0.75	0.86
14	B₂	1152	1091	13.12	2.29	0.75	0.86
15	B₂	860	815	3.92	9.33	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.895
C2	0.000	0.745	-0.391
C3	0.000	-0.745	-0.391
H4	0.921	1.269	-0.618
H5	-0.921	1.269	-0.618
H6	-0.921	-1.269	-0.618
H7	0.921	-1.269	-0.618

	O1	C2	C3	H4	H5	H6	H7
O1		1.4858	1.4858	2.1787	2.1787	2.1787	2.1787
C2	1.4858		1.4904	1.0833	1.0833	2.2261	2.2261
C3	1.4858	1.4904		2.2261	2.2261	1.0833	1.0833
H4	2.1787	1.0833	2.2261		1.8413	3.1351	2.5375
H5	2.1787	1.0833	2.2261	1.8413		2.5375	3.1351
H6	2.1787	2.2261	1.0833	3.1351	2.5375		1.8413
H7	2.1787	2.2261	1.0833	2.5375	3.1351	1.8413

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.897	O1	C2	H4	115.101
O1	C2	H5	115.101	O1	C3	C2	59.897
O1	C3	H6	115.101	O1	C3	H7	115.101
C2	O1	C3	60.205	C2	C3	H6	118.901
C2	C3	H7	118.901	C3	C2	H4	118.901
C3	C2	H5	118.901	H4	C2	H5	116.393
H6	C3	H7	116.393

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

using model chemistry: M06-2X/3-21G*

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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Number	Element	Mulliken
1	O	-0.454
2	C	-0.217
3	C	-0.217
4	H	0.222
5	H	0.222
6	H	0.222
7	H	0.222

	x	y	z	Total
	0.000	0.000	-2.420	2.420
CHELPG
AIM
ESP

<r²>	37.591
(<r²>)^1/2	6.131

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

using model chemistry: M06-2X/3-21G*

States and conformations

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