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	hartrees
Energy at 0K	-188.523037
Energy at 298.15K	-188.527171
HF Energy	-188.288152
Nuclear repulsion energy	105.845153

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3441	3059	5.21
2	A₁	1967	1749	25.37
3	A₁	1623	1443	0.35
4	A₁	1245	1106	1.14
5	A₁	1141	1014	2.11
6	A₁	827	735	0.00
7	A₂	3589	3190	0.00
8	A₂	1304	1159	0.00
9	A₂	782	695	0.00
10	B₁	3593	3194	0.10
11	B₁	1198	1065	0.01
12	B₁	813	723	0.31
13	B₁	356	316	1.12
14	B₂	3436	3055	4.50
15	B₂	1616	1437	0.00
16	B₂	1256	1116	6.67
17	B₂	1045	929	63.65
18	B₂	507	450	8.16

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.403
O2	0.000	0.000	1.646
C3	0.000	0.785	-0.893
C4	0.000	-0.785	-0.893
H5	0.925	1.287	-1.218
H6	-0.925	1.287	-1.218
H7	-0.925	-1.287	-1.218
H8	0.925	-1.287	-1.218

	C1	O2	C3	C4	H5	H6	H7	H8
C1		1.2435	1.5147	1.5147	2.2671	2.2671	2.2671	2.2671
O2	1.2435		2.6575	2.6575	3.2738	3.2738	3.2738	3.2738
C3	1.5147	2.6575		1.5697	1.1018	1.1018	2.2922	2.2922
C4	1.5147	2.6575	1.5697		2.2922	2.2922	1.1018	1.1018
H5	2.2671	3.2738	1.1018	2.2922		1.8502	3.1699	2.5739
H6	2.2671	3.2738	1.1018	2.2922	1.8502		2.5739	3.1699
H7	2.2671	3.2738	2.2922	1.1018	3.1699	2.5739		1.8502
H8	2.2671	3.2738	2.2922	1.1018	2.5739	3.1699	1.8502

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C4	58.791	C1	C3	H5	119.267
C1	C3	H6	119.267	C1	C4	C3	58.791
C1	C4	H7	119.267	C1	C4	H8	119.267
O2	C1	C3	148.791	O2	C1	C4	148.791
C3	C1	C4	62.417	C3	C4	H7	117.112
C3	C4	H8	117.112	C4	C3	H5	117.112
C4	C3	H6	117.112	H5	C3	H6	114.203
H7	C4	H8	114.203

All results from a given calculation for C₃H₄O (Cyclopropanone)

using model chemistry: MP2=FULL/STO-3G

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=FULL/STO-3G

States and conformations

All results from a given calculation for C₃H₄O (Cyclopropanone)