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	hartrees
Energy at 0K	-152.215798
Energy at 298.15K	-152.216849
HF Energy	-151.746640
Nuclear repulsion energy	57.819559

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3232	3232	30.77	120.89	0.08	0.15
2	A₁	2186	2186	535.79	17.62	0.47	0.64
3	A₁	1402	1402	14.57	3.89	0.22	0.36
4	A₁	1144	1144	1.71	48.44	0.15	0.26
5	B₁	586	586	50.46	1.11	0.75	0.86
6	B₁	527	527	64.98	4.76	0.75	0.86
7	B₂	3353	3353	9.06	48.33	0.75	0.86
8	B₂	981	981	2.06	0.08	0.75	0.86
9	B₂	435	435	1.93	0.00	0.75	0.86

Atom	y (Å)	z (Å)
C1	0.000	-1.228
C2	0.000	0.104
O3	0.000	1.282
H4	0.950	-1.755
H5	-0.950	-1.755

	C1	C2	O3	H4	H5
C1		1.3325	2.5098	1.0864	1.0864
C2	1.3325		1.1773	2.0877	2.0877
O3	2.5098	1.1773		3.1815	3.1815
H4	1.0864	2.0877	3.1815		1.9006
H5	1.0864	2.0877	3.1815	1.9006

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	O3	180.000		C2	C1	H4	118.987
C2	C1	H5	118.987		H4	C1	H5	122.027

All results from a given calculation for CH₂CO (Ketene)

using model chemistry: MP2=FULL/daug-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: MP2=FULL/daug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂CO (Ketene)