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	hartrees
Energy at 0K	-152.253461
Energy at 298.15K	-152.254497
HF Energy	-151.778566
Nuclear repulsion energy	58.590028

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3236	3089	22.92
2	A₁	2239	2137	660.82
3	A₁	1451	1385	13.98
4	A₁	1181	1127	5.52
5	B₁	579	553	42.92
6	B₁	492	470	98.02
7	B₂	3343	3190	5.31
8	B₂	1012	966	5.02
9	B₂	445	424	4.06

Atom	y (Å)	z (Å)
C1	0.000	-1.210
C2	0.000	0.103
O3	0.000	1.264
H4	0.940	-1.737
H5	-0.940	-1.737

	C1	C2	O3	H4	H5
C1		1.3134	2.4745	1.0770	1.0770
C2	1.3134		1.1611	2.0658	2.0658
O3	2.4745	1.1611		3.1445	3.1445
H4	1.0770	2.0658	3.1445		1.8792
H5	1.0770	2.0658	3.1445	1.8792

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	O3	180.000		C2	C1	H4	119.257
C2	C1	H5	119.257		H4	C1	H5	121.487

All results from a given calculation for CH₂CO (Ketene)

using model chemistry: CCSD/TZVP

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: CCSD/TZVP

States and conformations

All results from a given calculation for CH₂CO (Ketene)