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	hartrees
Energy at 0K	-151.183103
Energy at 298.15K	-151.184314
HF Energy	-150.874121
Nuclear repulsion energy	57.805728

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3200	3061	16.05
2	A₁	2201	2105	356.24
3	A₁	1504	1439	15.81
4	A₁	1180	1129	8.78
5	B₁	763	729	171.41
6	B₁	565	540	7.84
7	B₂	3285	3143	1.50
8	B₂	1091	1043	6.18
9	B₂	480	460	1.49

Atom	y (Å)	z (Å)
C1	0.000	-1.220
C2	0.000	0.096
O3	0.000	1.285
H4	0.934	-1.769
H5	-0.934	-1.769

	C1	C2	O3	H4	H5
C1		1.3161	2.5055	1.0838	1.0838
C2	1.3161		1.1894	2.0862	2.0862
O3	2.5055	1.1894		3.1943	3.1943
H4	1.0838	2.0862	3.1943		1.8687
H5	1.0838	2.0862	3.1943	1.8687

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	O3	180.000		C2	C1	H4	120.444
C2	C1	H5	120.444		H4	C1	H5	119.111

All results from a given calculation for CH₂CO (Ketene)

using model chemistry: CCD/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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All results from a given calculation for CH2CO (Ketene)

using model chemistry: CCD/3-21G*

States and conformations

All results from a given calculation for CH₂CO (Ketene)