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	hartrees
Energy at 0K	-116.259123
Energy at 298.15K	-116.262320
HF Energy	-115.832900
Nuclear repulsion energy	63.756912

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	3391	3185	0.07	151.46	0.14	0.25
2	A₁	3157	2965	53.53	111.16	0.17	0.28
3	A₁	1717	1613	19.56	33.47	0.10	0.18
4	A₁	1574	1479	2.45	13.04	0.24	0.39
5	A₁	1193	1120	0.05	19.23	0.13	0.23
6	A₁	955	897	5.67	5.45	0.44	0.61
7	A₂	1039	975	0.00	4.55	0.75	0.86
8	A₂	821	771	0.00	0.09	0.75	0.86
9	B₁	3239	3042	37.63	92.60	0.75	0.86
10	B₁	1143	1073	1.07	0.62	0.75	0.86
11	B₁	558	524	102.86	0.16	0.75	0.86
12	B₂	3346	3142	0.56	77.85	0.75	0.86
13	B₂	1109	1042	26.20	0.06	0.75	0.86
14	B₂	1063	999	35.12	0.07	0.75	0.86
15	B₂	807	758	15.37	14.97	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.861
C2	0.000	0.652	-0.499
C3	0.000	-0.652	-0.499
H4	0.000	1.581	-1.038
H5	0.000	-1.581	-1.038
H6	0.911	0.000	1.452
H7	-0.911	0.000	1.452

	C1	C2	C3	H4	H5	H6	H7
C1		1.5085	1.5085	2.4708	2.4708	1.0855	1.0855
C2	1.5085		1.3038	1.0737	2.2967	2.2496	2.2496
C3	1.5085	1.3038		2.2967	1.0737	2.2496	2.2496
H4	2.4708	1.0737	2.2967		3.1614	3.0865	3.0865
H5	2.4708	2.2967	1.0737	3.1614		3.0865	3.0865
H6	1.0855	2.2496	2.2496	3.0865	3.0865		1.8215
H7	1.0855	2.2496	2.2496	3.0865	3.0865	1.8215

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.396	C1	C2	H4	145.714
C1	C3	C2	64.396	C1	C3	H5	145.714
C2	C1	C3	51.207	C2	C1	H6	119.385
C2	C1	H7	119.385	C2	C3	H5	149.890
C3	C1	H6	119.385	C3	C1	H7	119.385
C3	C2	H4	149.890	H6	C1	H7	114.073

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: MP2=FULL/6-31+G**

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/6-31+G**

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)