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	hartrees
Energy at 0K	-116.380355
Energy at 298.15K	-116.383587
HF Energy	-115.866017
Nuclear repulsion energy	63.863989

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3328	3181	0.38
2	A₁	3088	2952	56.18
3	A₁	1720	1644	18.75
4	A₁	1541	1473	0.94
5	A₁	1174	1122	0.00
6	A₁	940	898	3.72
7	A₂	1031	986	0.00
8	A₂	856	818	0.00
9	B₁	3157	3017	33.74
10	B₁	1116	1067	1.78
11	B₁	600	573	81.67
12	B₂	3281	3136	0.76
13	B₂	1089	1041	20.23
14	B₂	1055	1008	32.30
15	B₂	809	773	16.08

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.863
C2	0.000	0.647	-0.500
C3	0.000	-0.647	-0.500
H4	0.000	1.576	-1.038
H5	0.000	-1.576	-1.038
H6	0.912	0.000	1.453
H7	-0.912	0.000	1.453

	C1	C2	C3	H4	H5	H6	H7
C1		1.5090	1.5090	2.4695	2.4695	1.0864	1.0864
C2	1.5090		1.2941	1.0737	2.2875	2.2507	2.2507
C3	1.5090	1.2941		2.2875	1.0737	2.2507	2.2507
H4	2.4695	1.0737	2.2875		3.1526	3.0858	3.0858
H5	2.4695	2.2875	1.0737	3.1526		3.0858	3.0858
H6	1.0864	2.2507	2.2507	3.0858	3.0858		1.8245
H7	1.0864	2.2507	2.2507	3.0858	3.0858	1.8245

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.609	C1	C2	H4	145.451
C1	C3	C2	64.609	C1	C3	H5	145.451
C2	C1	C3	50.782	C2	C1	H6	119.380
C2	C1	H7	119.380	C2	C3	H5	149.940
C3	C1	H6	119.380	C3	C1	H7	119.380
C3	C2	H4	149.940	H6	C1	H7	114.216

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: CCSD/aug-cc-pVTZ

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: CCSD/aug-cc-pVTZ

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)