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	hartrees
Energy at 0K	-151.497637
Energy at 298.15K	-151.500247
HF Energy	-151.497637
Nuclear repulsion energy	63.073463

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3213	3155	1.03
2	A'	3093	3037	0.47
3	A'	2856	2805	95.77
4	A'	1488	1462	11.41
5	A'	1447	1421	15.24
6	A'	1372	1347	11.20
7	A'	1174	1153	8.50
8	A'	973	956	2.85
9	A'	484	475	10.02
10	A"	987	969	1.71
11	A"	749	736	63.58
12	A"	423	415	2.62

Atom	x (Å)	y (Å)
C1	0.000	0.422
H2	0.298	1.498
C3	1.074	-0.487
O4	-1.214	0.074
H5	2.111	-0.138
H6	0.862	-1.560

	C1	H2	C3	O4	H5	H6
C1		1.1171	1.4065	1.2631	2.1836	2.1609
H2	1.1171		2.1308	2.0776	2.4414	3.1096
C3	1.4065	2.1308		2.3559	1.0939	1.0943
O4	1.2631	2.0776	2.3559		3.3318	2.6418
H5	2.1836	2.4414	1.0939	3.3318		1.8930
H6	2.1609	3.1096	1.0943	2.6418	1.8930

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	121.185	C1	C3	H6	119.027
H2	C1	C3	114.723	H2	C1	O4	121.472
C3	C1	O4	123.805	H5	C3	H6	119.788

All results from a given calculation for CH₂CHO (Vinyloxy radical)

using model chemistry: LSDA/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	C	0.114
2	H	0.175
3	C	-0.402
4	O	-0.362
5	H	0.229
6	H	0.247

	x	y	z	Total
	2.618	-0.110	0.000	2.620
CHELPG
AIM
ESP

	x	y	z
x	4.578	-0.319	0.000
y	-0.319	3.516	0.000
z	0.000	0.000	1.241

<r²>	42.324
(<r²>)^1/2	6.506

All results from a given calculation for CH2CHO (Vinyloxy radical)

using model chemistry: LSDA/3-21G*

States and conformations

All results from a given calculation for CH₂CHO (Vinyloxy radical)