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	hartrees
Energy at 0K	-194.305146
Energy at 298.15K	-194.313263
HF Energy	-193.872600
Nuclear repulsion energy	159.568136

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3262	3148	34.84
2	A'	3253	3140	26.72
3	A'	3171	3061	11.27
4	A'	3148	3039	10.44
5	A'	3145	3036	9.90
6	A'	3126	3018	19.42
7	A'	1657	1600	19.88
8	A'	1530	1477	1.93
9	A'	1498	1446	0.82
10	A'	1366	1318	1.26
11	A'	1329	1283	1.83
12	A'	1249	1206	3.63
13	A'	1206	1164	0.50
14	A'	1132	1093	11.26
15	A'	1024	989	7.59
16	A'	938	905	32.09
17	A'	843	813	2.39
18	A'	779	752	2.91
19	A'	440	424	1.34
20	A'	265	255	0.87
21	A"	3246	3133	0.05
22	A"	3141	3032	23.59
23	A"	1510	1458	3.26
24	A"	1229	1186	0.93
25	A"	1176	1135	2.09
26	A"	1134	1095	9.37
27	A"	999	964	26.36
28	A"	946	913	1.84
29	A"	854	824	61.64
30	A"	823	795	18.35
31	A"	673	650	4.51
32	A"	312	301	1.87
33	A"	113	109	0.12

Atom	x (Å)	y (Å)	z (Å)
C1	-0.396	0.288	0.000
C2	0.263	-1.062	0.000
C3	-0.411	-2.254	0.000
C4	0.263	1.467	0.775
C5	0.263	1.467	-0.775
H6	-1.492	0.265	0.000
H7	1.363	-1.066	0.000
H8	0.120	-3.210	0.000
H9	-1.505	-2.292	0.000
H10	-0.397	2.170	1.290
H11	1.210	1.265	1.286
H12	-0.397	2.170	-1.290
H13	1.210	1.265	-1.286

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.5030	2.5428	1.5568	1.5568	1.0963	2.2204	3.5360	2.8088	2.2813	2.2776	2.2813	2.2776
C2	1.5030		1.3694	2.6449	2.6449	2.2010	1.1003	2.1521	2.1540	3.5422	2.8225	3.5422	2.8225
C3	2.5428	1.3694		3.8600	3.8600	2.7420	2.1356	1.0931	1.0951	4.6085	4.0825	4.6085	4.0825
C4	1.5568	2.6449	3.8600		1.5502	2.2639	2.8677	4.7421	4.2256	1.0936	1.0945	2.2794	2.2771
C5	1.5568	2.6449	3.8600	1.5502		2.2639	2.8677	4.7421	4.2256	2.2794	2.2771	1.0936	1.0945
H6	1.0963	2.2010	2.7420	2.2639	2.2639		3.1508	3.8311	2.5576	2.5478	3.1551	2.5478	3.1551
H7	2.2204	1.1003	2.1356	2.8677	2.8677	3.1508		2.4782	3.1199	3.9030	2.6665	3.9030	2.6665
H8	3.5360	2.1521	1.0931	4.7421	4.7421	3.8311	2.4782		1.8667	5.5562	4.7816	5.5562	4.7816
H9	2.8088	2.1540	1.0951	4.2256	4.2256	2.5576	3.1199	1.8667		4.7752	4.6561	4.7752	4.6561
H10	2.2813	3.5422	4.6085	1.0936	2.2794	2.5478	3.9030	5.5562	4.7752		1.8441	2.5803	3.1683
H11	2.2776	2.8225	4.0825	1.0945	2.2771	3.1551	2.6665	4.7816	4.6561	1.8441		3.1683	2.5723
H12	2.2813	3.5422	4.6085	2.2794	1.0936	2.5478	3.9030	5.5562	4.7752	2.5803	3.1683		1.8441
H13	2.2776	2.8225	4.0825	2.2771	1.0945	3.1551	2.6665	4.7816	4.6561	3.1683	2.5723	1.8441

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.496	C1	C2	H7	116.204
C1	C4	C5	60.140	C1	C4	H10	117.745
C1	C4	H11	117.356	C1	C5	C4	60.140
C1	C5	H12	117.745	C1	C5	H13	117.356
C2	C1	C4	119.619	C2	C1	C5	119.619
C2	C1	H6	114.821	C2	C3	H8	121.438
C2	C3	H9	121.464	C3	C2	H7	119.300
C4	C1	H6	116.062	C4	C5	H12	118.099
C4	C5	H13	117.835	C5	C1	H6	116.062
C5	C4	H10	118.099	C5	C4	H11	117.835
H8	C3	H9	117.098	H10	C4	H11	114.875
H12	C5	H13	114.875

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)

using model chemistry: MP2/SDD

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 C5H8 (Ethenylcyclopropane)

using model chemistry: MP2/SDD

States and conformations

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)