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	hartrees
Energy at 0K	-152.928037
Energy at 298.15K	-152.932847
Nuclear repulsion energy	76.507628

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3252	2969	13.97
2	A₁	1679	1533	3.85
3	A₁	1415	1292	19.31
4	A₁	1291	1179	3.64
5	A₁	979	894	89.34
6	A₂	3321	3032	0.00
7	A₂	1275	1164	0.00
8	A₂	1150	1050	0.00
9	B₁	3338	3048	57.23
10	B₁	1284	1172	7.97
11	B₁	876	800	0.11
12	B₂	3240	2959	51.26
13	B₂	1629	1488	0.03
14	B₂	1293	1181	0.02
15	B₂	967	883	11.65

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.832
C2	0.000	0.725	-0.363
C3	0.000	-0.725	-0.363
H4	0.908	1.259	-0.576
H5	-0.908	1.259	-0.576
H6	-0.908	-1.259	-0.576
H7	0.908	-1.259	-0.576

	O1	C2	C3	H4	H5	H6	H7
O1		1.3979	1.3979	2.0965	2.0965	2.0965	2.0965
C2	1.3979		1.4498	1.0752	1.0752	2.1924	2.1924
C3	1.3979	1.4498		2.1924	2.1924	1.0752	1.0752
H4	2.0965	1.0752	2.1924		1.8168	3.1050	2.5180
H5	2.0965	1.0752	2.1924	1.8168		2.5180	3.1050
H6	2.0965	2.1924	1.0752	3.1050	2.5180		1.8168
H7	2.0965	2.1924	1.0752	2.5180	3.1050	1.8168

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	58.764	O1	C2	H4	115.309
O1	C2	H5	115.309	O1	C3	C2	58.764
O1	C3	H6	115.309	O1	C3	H7	115.309
C2	O1	C3	62.473	C2	C3	H6	119.786
C2	C3	H7	119.786	C3	C2	H4	119.786
C3	C2	H5	119.786	H4	C2	H5	115.308
H6	C3	H7	115.308

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

using model chemistry: HF/cc-pCVTZ

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	-0.378
2	C	0.038
3	C	0.038
4	H	0.075
5	H	0.075
6	H	0.075
7	H	0.075

	x	y	z	Total
	0.000	0.000	-2.068	2.068
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: HF/cc-pCVTZ

States and conformations

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