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	hartrees
Energy at 0K	-194.580647
Energy at 298.15K	-194.588862
HF Energy	-193.938967
Nuclear repulsion energy	162.991261

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3306	3118	14.49
2	A'	3303	3115	12.20
3	A'	3215	3032	3.27
4	A'	3214	3031	6.50
5	A'	3207	3024	9.79
6	A'	3185	3003	8.87
7	A'	1730	1632	15.22
8	A'	1567	1478	1.11
9	A'	1513	1427	0.22
10	A'	1398	1318	0.59
11	A'	1348	1271	3.17
12	A'	1273	1200	3.03
13	A'	1263	1191	1.41
14	A'	1105	1042	3.17
15	A'	1036	977	5.34
16	A'	1003	946	32.91
17	A'	855	806	0.96
18	A'	796	751	0.22
19	A'	451	426	0.97
20	A'	273	257	1.08
21	A"	3291	3104	0.09
22	A"	3203	3021	13.44
23	A"	1526	1439	1.42
24	A"	1238	1167	0.63
25	A"	1166	1100	2.50
26	A"	1106	1043	5.45
27	A"	1027	968	11.71
28	A"	957	902	8.39
29	A"	905	853	41.21
30	A"	863	813	6.47
31	A"	684	645	4.46
32	A"	318	300	1.23
33	A"	120	113	0.06

Atom	x (Å)	y (Å)	z (Å)
C1	-0.388	0.288	0.000
C2	0.258	-1.038	0.000
C3	-0.403	-2.204	0.000
C4	0.258	1.432	0.749
C5	0.258	1.432	-0.749
H6	-1.476	0.271	0.000
H7	1.349	-1.043	0.000
H8	0.120	-3.155	0.000
H9	-1.489	-2.241	0.000
H10	-0.393	2.129	1.268
H11	1.193	1.227	1.261
H12	-0.393	2.129	-1.268
H13	1.193	1.227	-1.261

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.4749	2.4921	1.5123	1.5123	1.0881	2.1881	3.4795	2.7586	2.2352	2.2296	2.2352	2.2296
C2	1.4749		1.3402	2.5815	2.5815	2.1724	1.0915	2.1207	2.1208	3.4729	2.7565	3.4729	2.7565
C3	2.4921	1.3402		3.7710	3.7710	2.6977	2.1021	1.0846	1.0863	4.5147	3.9892	4.5147	3.9892
C4	1.5123	2.5815	3.7710		1.4982	2.2167	2.8070	4.6494	4.1360	1.0850	1.0856	2.2306	2.2262
C5	1.5123	2.5815	3.7710	1.4982		2.2167	2.8070	4.6494	4.1360	2.2306	2.2262	1.0850	1.0856
H6	1.0881	2.1724	2.6977	2.2167	2.2167		3.1156	3.7789	2.5126	2.4961	3.1026	2.4961	3.1026
H7	2.1881	1.0915	2.1021	2.8070	2.8070	3.1156		2.4433	3.0806	3.8343	2.6018	3.8343	2.6018
H8	3.4795	2.1207	1.0846	4.6494	4.6494	3.7789	2.4433		1.8496	5.4574	4.6844	5.4574	4.6844
H9	2.7586	2.1208	1.0863	4.1360	4.1360	2.5126	3.0806	1.8496		4.6805	4.5624	4.6805	4.5624
H10	2.2352	3.4729	4.5147	1.0850	2.2306	2.4961	3.8343	5.4574	4.6805		1.8240	2.5352	3.1176
H11	2.2296	2.7565	3.9892	1.0856	2.2262	3.1026	2.6018	4.6844	4.5624	1.8240		3.1176	2.5213
H12	2.2352	3.4729	4.5147	2.2306	1.0850	2.4961	3.8343	5.4574	4.6805	2.5352	3.1176		1.8240
H13	2.2296	2.7565	3.9892	2.2262	1.0856	3.1026	2.6018	4.6844	4.5624	3.1176	2.5213	1.8240

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.501	C1	C2	H7	116.201
C1	C4	C5	60.309	C1	C4	H10	117.824
C1	C4	H11	117.292	C1	C5	C4	60.309
C1	C5	H12	117.824	C1	C5	H13	117.292
C2	C1	C4	119.579	C2	C1	C5	119.579
C2	C1	H6	115.072	C2	C3	H8	121.634
C2	C3	H9	121.512	C3	C2	H7	119.298
C4	C1	H6	115.996	C4	C5	H12	118.547
C4	C5	H13	118.115	C5	C1	H6	115.996
C5	C4	H10	118.547	C5	C4	H11	118.115
H8	C3	H9	116.855	H10	C4	H11	114.350
H12	C5	H13	114.350

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)