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	hartrees
Energy at 0K	-116.398255
Energy at 298.15K	-116.401485
HF Energy	-115.865384
Nuclear repulsion energy	64.087141

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	3362	3192	0.41	147.16	0.15	0.26
2	A₁	3128	2970	51.56	134.77	0.13	0.23
3	A₁	1703	1617	15.40	28.57	0.14	0.24
4	A₁	1544	1465	1.18	13.21	0.21	0.35
5	A₁	1180	1120	0.07	13.52	0.13	0.23
6	A₁	941	893	5.09	4.62	0.58	0.74
7	A₂	1036	984	0.00	5.65	0.75	0.86
8	A₂	854	811	0.00	0.06	0.75	0.86
9	B₁	3195	3033	30.88	82.50	0.75	0.86
10	B₁	1128	1071	1.46	1.26	0.75	0.86
11	B₁	596	566	76.65	0.63	0.75	0.86
12	B₂	3307	3140	1.32	70.35	0.75	0.86
13	B₂	1085	1030	16.84	0.00	0.75	0.86
14	B₂	1044	992	39.45	0.00	0.75	0.86
15	B₂	811	770	14.09	14.08	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.858
C2	0.000	0.647	-0.498
C3	0.000	-0.647	-0.498
H4	0.000	1.573	-1.031
H5	0.000	-1.573	-1.031
H6	0.909	0.000	1.443
H7	-0.909	0.000	1.443

	C1	C2	C3	H4	H5	H6	H7
C1		1.5022	1.5022	2.4585	2.4585	1.0810	1.0810
C2	1.5022		1.2941	1.0687	2.2832	2.2385	2.2385
C3	1.5022	1.2941		2.2832	1.0687	2.2385	2.2385
H4	2.4585	1.0687	2.2832		3.1459	3.0696	3.0696
H5	2.4585	2.2832	1.0687	3.1459		3.0696	3.0696
H6	1.0810	2.2385	2.2385	3.0696	3.0696		1.8182
H7	1.0810	2.2385	2.2385	3.0696	3.0696	1.8182

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.486	C1	C2	H4	145.472
C1	C3	C2	64.486	C1	C3	H5	145.472
C2	C1	C3	51.027	C2	C1	H6	119.226
C2	C1	H7	119.226	C2	C3	H5	150.041
C3	C1	H6	119.226	C3	C1	H7	119.226
C3	C2	H4	150.041	H6	C1	H7	114.494

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: MP2=FULL/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: MP2=FULL/cc-pVTZ

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)