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	hartrees
Energy at 0K	-116.309981
Energy at 298.15K	-116.313289
HF Energy	-115.863959
Nuclear repulsion energy	64.321454

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3408	3149	0.86
2	A₁	3149	2909	60.16
3	A₁	1789	1653	18.94
4	A₁	1584	1464	0.97
5	A₁	1214	1121	0.00
6	A₁	970	896	3.95
7	A₂	1062	981	0.00
8	A₂	912	843	0.00
9	B₁	3219	2974	35.69
10	B₁	1154	1066	2.05
11	B₁	636	588	87.94
12	B₂	3360	3105	1.80
13	B₂	1132	1046	22.08
14	B₂	1099	1016	33.17
15	B₂	847	782	18.57

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.856
C2	0.000	0.641	-0.497
C3	0.000	-0.641	-0.497
H4	0.000	1.566	-1.032
H5	0.000	-1.566	-1.032
H6	0.906	0.000	1.447
H7	-0.906	0.000	1.447

	C1	C2	C3	H4	H5	H6	H7
C1		1.4977	1.4977	2.4531	2.4531	1.0819	1.0819
C2	1.4977		1.2819	1.0685	2.2708	2.2390	2.2390
C3	1.4977	1.2819		2.2708	1.0685	2.2390	2.2390
H4	2.4531	1.0685	2.2708		3.1322	3.0691	3.0691
H5	2.4531	2.2708	1.0685	3.1322		3.0691	3.0691
H6	1.0819	2.2390	2.2390	3.0691	3.0691		1.8126
H7	1.0819	2.2390	2.2390	3.0691	3.0691	1.8126

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.662	C1	C2	H4	145.355
C1	C3	C2	64.662	C1	C3	H5	145.355
C2	C1	C3	50.676	C2	C1	H6	119.577
C2	C1	H7	119.577	C2	C3	H5	149.982
C3	C1	H6	119.577	C3	C1	H7	119.577
C3	C2	H4	149.982	H6	C1	H7	113.796

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: CID/6-311+G(3df,2p)

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: CID/6-311+G(3df,2p)

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)