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	hartrees
Energy at 0K	-190.045306
Energy at 298.15K	-190.049594
HF Energy	-189.649412
Nuclear repulsion energy	106.899534

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3191	3046	0.34
2	A₁	1808	1725	119.24
3	A₁	1522	1453	6.23
4	A₁	1118	1067	48.99
5	A₁	975	931	0.29
6	A₁	692	660	1.37
7	A₂	3276	3126	0.00
8	A₂	1203	1148	0.00
9	A₂	735	702	0.00
10	B₁	3289	3140	1.71
11	B₁	1160	1108	0.13
12	B₁	753	719	2.04
13	B₁	409	391	1.90
14	B₂	3187	3042	0.72
15	B₂	1510	1442	6.13
16	B₂	1139	1087	0.96
17	B₂	972	928	153.61
18	B₂	519	496	0.21

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.385
O2	0.000	0.000	1.617
C3	0.000	0.801	-0.876
C4	0.000	-0.801	-0.876
H5	0.917	1.291	-1.185
H6	-0.917	1.291	-1.185
H7	-0.917	-1.291	-1.185
H8	0.917	-1.291	-1.185

	C1	O2	C3	C4	H5	H6	H7	H8
C1		1.2320	1.4938	1.4938	2.2305	2.2305	2.2305	2.2305
O2	1.2320		2.6183	2.6183	3.2192	3.2192	3.2192	3.2192
C3	1.4938	2.6183		1.6028	1.0849	1.0849	2.3058	2.3058
C4	1.4938	2.6183	1.6028		2.3058	2.3058	1.0849	1.0849
H5	2.2305	3.2192	1.0849	2.3058		1.8341	3.1676	2.5826
H6	2.2305	3.2192	1.0849	2.3058	1.8341		2.5826	3.1676
H7	2.2305	3.2192	2.3058	1.0849	3.1676	2.5826		1.8341
H8	2.2305	3.2192	2.3058	1.0849	2.5826	3.1676	1.8341

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C4	57.554	C1	C3	H5	118.906
C1	C3	H6	118.906	C1	C4	C3	57.554
C1	C4	H7	118.906	C1	C4	H8	118.906
O2	C1	C3	147.554	O2	C1	C4	147.554
C3	C1	C4	64.891	C3	C4	H7	116.843
C3	C4	H8	116.843	C4	C3	H5	116.843
C4	C3	H6	116.843	H5	C3	H6	115.401
H7	C4	H8	115.401

All results from a given calculation for C₃H₄O (Cyclopropanone)

using model chemistry: MP2/3-21G

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 C3H4O (Cyclopropanone)

using model chemistry: MP2/3-21G

States and conformations

All results from a given calculation for C₃H₄O (Cyclopropanone)