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	hartrees
Energy at 0K	-116.389470
Energy at 298.15K	-116.392680
HF Energy	-115.872656
Nuclear repulsion energy	63.964827

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	3344	3171	0.31	153.38	0.12	0.22
2	A₁	3112	2951	50.90	139.70	0.12	0.21
3	A₁	1692	1605	16.11	34.58	0.10	0.18
4	A₁	1532	1453	0.95	12.50	0.19	0.32
5	A₁	1168	1108	0.03	16.26	0.11	0.19
6	A₁	933	885	4.97	4.40	0.56	0.72
7	A₂	1028	975	0.00	3.79	0.75	0.86
8	A₂	847	804	0.00	0.11	0.75	0.86
9	B₁	3194	3029	28.37	87.35	0.75	0.86
10	B₁	1120	1062	1.36	0.57	0.75	0.86
11	B₁	588	558	78.02	0.42	0.75	0.86
12	B₂	3300	3130	1.46	72.94	0.75	0.86
13	B₂	1072	1017	14.79	0.01	0.75	0.86
14	B₂	1037	984	39.93	0.01	0.75	0.86
15	B₂	805	763	14.38	13.37	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.860
C2	0.000	0.648	-0.499
C3	0.000	-0.648	-0.499
H4	0.000	1.576	-1.035
H5	0.000	-1.576	-1.035
H6	0.912	0.000	1.446
H7	-0.912	0.000	1.446

	C1	C2	C3	H4	H5	H6	H7
C1		1.5049	1.5049	2.4646	2.4646	1.0838	1.0838
C2	1.5049		1.2954	1.0724	2.2879	2.2431	2.2431
C3	1.5049	1.2954		2.2879	1.0724	2.2431	2.2431
H4	2.4646	1.0724	2.2879		3.1530	3.0772	3.0772
H5	2.4646	2.2879	1.0724	3.1530		3.0772	3.0772
H6	1.0838	2.2431	2.2431	3.0772	3.0772		1.8234
H7	1.0838	2.2431	2.2431	3.0772	3.0772	1.8234

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.509	C1	C2	H4	145.480
C1	C3	C2	64.509	C1	C3	H5	145.480
C2	C1	C3	50.983	C2	C1	H6	119.215
C2	C1	H7	119.215	C2	C3	H5	150.011
C3	C1	H6	119.215	C3	C1	H7	119.215
C3	C2	H4	150.011	H6	C1	H7	114.534

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: MP2/cc-pVQZ

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 C3H4 (cyclopropene)

using model chemistry: MP2/cc-pVQZ

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)