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	hartrees
Energy at 0K	-153.636022
Energy at 298.15K
HF Energy	-153.636022
Nuclear repulsion energy	75.438679

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	3129	2987	14.22	216.22	0.09	0.17
2	A₁	1553	1483	5.04	3.07	0.39	0.57
3	A₁	1329	1269	15.22	30.94	0.14	0.25
4	A₁	1164	1111	0.01	1.23	0.20	0.34
5	A₁	927	885	79.10	11.34	0.73	0.84
6	A₂	3210	3065	0.00	115.36	0.75	0.86
7	A₂	1177	1124	0.00	2.61	0.75	0.86
8	A₂	1049	1002	0.00	0.25	0.75	0.86
9	B₁	3224	3078	43.03	23.58	0.75	0.86
10	B₁	1177	1124	3.64	6.43	0.75	0.86
11	B₁	821	784	0.17	4.75	0.75	0.86
12	B₂	3121	2980	34.37	11.16	0.75	0.86
13	B₂	1508	1440	0.00	6.61	0.75	0.86
14	B₂	1159	1106	1.43	1.56	0.75	0.86
15	B₂	897	856	11.75	4.78	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.849
C2	0.000	0.732	-0.370
C3	0.000	-0.732	-0.370
H4	0.922	1.269	-0.588
H5	-0.922	1.269	-0.588
H6	-0.922	-1.269	-0.588
H7	0.922	-1.269	-0.588

	O1	C2	C3	H4	H5	H6	H7
O1		1.4217	1.4217	2.1269	2.1269	2.1269	2.1269
C2	1.4217		1.4635	1.0890	1.0890	2.2138	2.2138
C3	1.4217	1.4635		2.2138	2.2138	1.0890	1.0890
H4	2.1269	1.0890	2.2138		1.8438	3.1373	2.5383
H5	2.1269	1.0890	2.2138	1.8438		2.5383	3.1373
H6	2.1269	2.2138	1.0890	3.1373	2.5383		1.8438
H7	2.1269	2.2138	1.0890	2.5383	3.1373	1.8438

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	59.021	O1	C2	H4	115.163
O1	C2	H5	115.163	O1	C3	C2	59.021
O1	C3	H6	115.163	O1	C3	H7	115.163
C2	O1	C3	61.957	C2	C3	H6	119.568
C2	C3	H7	119.568	C3	C2	H4	119.568
C3	C2	H5	119.568	H4	C2	H5	115.674
H6	C3	H7	115.674

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

using model chemistry: HSEh1PBE/6-31+G**

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	-0.321
2	C	-0.158
3	C	-0.158
4	H	0.159
5	H	0.159
6	H	0.159
7	H	0.159

	x	y	z	Total
	0.000	0.000	-2.086	2.086
CHELPG
AIM
ESP

<r²>	36.485
(<r²>)^1/2	6.040

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

using model chemistry: HSEh1PBE/6-31+G**

States and conformations

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