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	hartrees
Energy at 0K	-152.142143
Energy at 298.15K	-152.143274
HF Energy	-151.740093
Nuclear repulsion energy	58.448676

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3292	3042	28.44
2	A₁	2303	2128	689.23
3	A₁	1463	1352	11.74
4	A₁	1207	1115	6.91
5	B₁	622	575	46.01
6	B₁	566	523	98.19
7	B₂	3409	3150	8.21
8	B₂	1029	951	6.00
9	B₂	460	425	4.55

Atom	y (Å)	z (Å)
C1	0.000	-1.215
C2	0.000	0.107
O3	0.000	1.266
H4	0.948	-1.741
H5	-0.948	-1.741

	C1	C2	O3	H4	H5
C1		1.3217	2.4804	1.0850	1.0850
C2	1.3217		1.1587	2.0777	2.0777
O3	2.4804	1.1587		3.1533	3.1533
H4	1.0850	2.0777	3.1533		1.8970
H5	1.0850	2.0777	3.1533	1.8970

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	O3	180.000		C2	C1	H4	119.053
C2	C1	H5	119.053		H4	C1	H5	121.895

All results from a given calculation for CH₂CO (Ketene)

using model chemistry: CID/cc-pVDZ

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: CID/cc-pVDZ

States and conformations

All results from a given calculation for CH₂CO (Ketene)