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	hartrees
Energy at 0K	-152.422085
Energy at 298.15K	-152.423128
HF Energy	-151.790391
Nuclear repulsion energy	58.454779

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3202	3202
2	A₁	2191	2191
3	A₁	1426	1426
4	A₁	1153	1153
5	B₁	590	590
6	B₁	519	519
7	B₂	3305	3305
8	B₂	997	997
9	B₂	434	434

Atom	y (Å)	z (Å)
C1	0.000	-1.214
C2	0.000	0.103
O3	0.000	1.268
H4	0.939	-1.738
H5	-0.939	-1.738

	C1	C2	O3	H4	H5
C1		1.3172	2.4817	1.0757	1.0757
C2	1.3172		1.1645	2.0672	2.0672
O3	2.4817	1.1645		3.1494	3.1494
H4	1.0757	2.0672	3.1494		1.8784
H5	1.0757	2.0672	3.1494	1.8784

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	O3	180.000		C2	C1	H4	119.176
C2	C1	H5	119.176		H4	C1	H5	121.648

All results from a given calculation for CH₂CO (Ketene)

using model chemistry: QCISD(T)=FULL/Def2TZVPP

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: QCISD(T)=FULL/Def2TZVPP

States and conformations

All results from a given calculation for CH₂CO (Ketene)