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	hartrees
Energy at 0K	-116.332495
Energy at 298.15K	-116.335715
HF Energy	-115.850606
Nuclear repulsion energy	63.659493

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	3352	3180	0.10	148.23	0.15	0.26
2	A₁	3113	2953	54.56	132.05	0.15	0.26
3	A₁	1693	1606	14.60	22.26	0.17	0.29
4	A₁	1541	1462	1.69	14.17	0.24	0.38
5	A₁	1182	1121	0.24	10.48	0.16	0.28
6	A₁	941	893	4.87	5.88	0.55	0.71
7	A₂	1033	980	0.00	8.62	0.75	0.86
8	A₂	845	801	0.00	0.00	0.75	0.86
9	B₁	3193	3029	43.52	88.31	0.75	0.86
10	B₁	1128	1070	1.68	2.19	0.75	0.86
11	B₁	591	560	79.66	0.92	0.75	0.86
12	B₂	3306	3136	0.55	73.91	0.75	0.86
13	B₂	1085	1029	26.58	0.22	0.75	0.86
14	B₂	1041	988	32.10	0.01	0.75	0.86
15	B₂	808	767	12.75	15.18	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.863
C2	0.000	0.652	-0.501
C3	0.000	-0.652	-0.501
H4	0.000	1.585	-1.038
H5	0.000	-1.585	-1.038
H6	0.916	0.000	1.454
H7	-0.916	0.000	1.454

	C1	C2	C3	H4	H5	H6	H7
C1		1.5109	1.5109	2.4749	2.4749	1.0897	1.0897
C2	1.5109		1.3032	1.0769	2.3000	2.2542	2.2542
C3	1.5109	1.3032		2.3000	1.0769	2.2542	2.2542
H4	2.4749	1.0769	2.3000		3.1693	3.0918	3.0918
H5	2.4749	2.3000	1.0769	3.1693		3.0918	3.0918
H6	1.0897	2.2542	2.2542	3.0918	3.0918		1.8312
H7	1.0897	2.2542	2.2542	3.0918	3.0918	1.8312

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.453	C1	C2	H4	145.509
C1	C3	C2	64.453	C1	C3	H5	145.509
C2	C1	C3	51.095	C2	C1	H6	119.290
C2	C1	H7	119.290	C2	C3	H5	150.038
C3	C1	H6	119.290	C3	C1	H7	119.290
C3	C2	H4	150.038	H6	C1	H7	114.326

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: MP2=FULL/6-311G**

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/6-311G**

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)