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	hartrees
Energy at 0K	-152.336365
Energy at 298.15K	-152.337471
HF Energy	-151.786844
Nuclear repulsion energy	58.693912

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3222	3084	28.15
2	A₁	2247	2150	724.43
3	A₁	1440	1378	12.97
4	A₁	1180	1130	4.10
5	B₁	614	588	62.03
6	B₁	550	527	50.60
7	B₂	3327	3184	7.06
8	B₂	1012	968	2.44
9	B₂	450	431	3.44

Atom	y (Å)	z (Å)
C1	0.000	-1.209
C2	0.000	0.104
O3	0.000	1.261
H4	0.941	-1.731
H5	-0.941	-1.731

	C1	C2	O3	H4	H5
C1		1.3133	2.4706	1.0763	1.0763
C2	1.3133		1.1572	2.0628	2.0628
O3	2.4706	1.1572		3.1373	3.1373
H4	1.0763	2.0628	3.1373		1.8821
H5	1.0763	2.0628	3.1373	1.8821

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	O3	180.000		C2	C1	H4	119.031
C2	C1	H5	119.031		H4	C1	H5	121.938

All results from a given calculation for CH₂CO (Ketene)

using model chemistry: CCD/aug-cc-pVTZ

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/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂CO (Ketene)