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	hartrees
Energy at 0K	-193.309270
Energy at 298.15K	-193.317509
HF Energy	-192.853536
Nuclear repulsion energy	161.711846

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3299	3127	12.30
2	A'	3260	3091	15.89
3	A'	3208	3041	3.83
4	A'	3200	3034	7.39
5	A'	3175	3010	4.70
6	A'	3144	2980	9.35
7	A'	1690	1603	12.15
8	A'	1572	1490	1.15
9	A'	1542	1462	0.38
10	A'	1389	1317	1.55
11	A'	1381	1309	1.09
12	A'	1270	1204	2.08
13	A'	1176	1115	2.87
14	A'	1140	1081	10.37
15	A'	1067	1012	4.09
16	A'	938	890	27.49
17	A'	841	797	1.23
18	A'	795	754	1.72
19	A'	457	433	1.46
20	A'	277	263	0.76
21	A"	3283	3112	0.05
22	A"	3196	3030	11.42
23	A"	1559	1478	2.54
24	A"	1244	1179	0.66
25	A"	1192	1130	2.18
26	A"	1152	1093	8.88
27	A"	1042	988	13.33
28	A"	958	909	0.21
29	A"	940	891	49.24
30	A"	825	782	15.21
31	A"	687	652	3.39
32	A"	325	308	1.82
33	A"	113	107	0.07

Atom	x (Å)	y (Å)	z (Å)
C1	-0.409	0.286	0.000
C2	0.256	-1.042	0.000
C3	-0.382	-2.224	0.000
C4	0.256	1.445	0.763
C5	0.256	1.445	-0.763
H6	-1.495	0.265	0.000
H7	1.348	-1.019	0.000
H8	0.157	-3.166	0.000
H9	-1.468	-2.286	0.000
H10	-0.392	2.147	1.273
H11	1.189	1.228	1.271
H12	-0.392	2.147	-1.273
H13	1.189	1.228	-1.271

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.4845	2.5100	1.5389	1.5389	1.0862	2.1880	3.4976	2.7815	2.2550	2.2485	2.2550	2.2485
C2	1.4845		1.3441	2.6008	2.6008	2.1850	1.0919	2.1267	2.1264	3.4938	2.7635	3.4938	2.7635
C3	2.5100	1.3441		3.8015	3.8015	2.7268	2.1089	1.0852	1.0871	4.5525	4.0003	4.5525	4.0003
C4	1.5389	2.6008	3.8015		1.5266	2.2448	2.8006	4.6744	4.1804	1.0832	1.0837	2.2496	2.2486
C5	1.5389	2.6008	3.8015	1.5266		2.2448	2.8006	4.6744	4.1804	2.2496	2.2486	1.0832	1.0837
H6	1.0862	2.1850	2.7268	2.2448	2.2448		3.1193	3.8081	2.5519	2.5249	3.1214	2.5249	3.1214
H7	2.1880	1.0919	2.1089	2.8006	2.8006	3.1193		2.4554	3.0879	3.8301	2.5865	3.8301	2.5865
H8	3.4976	2.1267	1.0852	4.6744	4.6744	3.8081	2.4554		1.8475	5.4905	4.6891	5.4905	4.6891
H9	2.7815	2.1264	1.0871	4.1804	4.1804	2.5519	3.0879	1.8475		4.7359	4.5851	4.7359	4.5851
H10	2.2550	3.4938	4.5525	1.0832	2.2496	2.5249	3.8301	5.4905	4.7359		1.8285	2.5465	3.1335
H11	2.2485	2.7635	4.0003	1.0837	2.2486	3.1214	2.5865	4.6891	4.5851	1.8285		3.1335	2.5429
H12	2.2550	3.4938	4.5525	2.2496	1.0832	2.5249	3.8301	5.4905	4.7359	2.5465	3.1335		1.8285
H13	2.2485	2.7635	4.0003	2.2486	1.0837	3.1214	2.5865	4.6891	4.5851	3.1335	2.5429	1.8285

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	125.016	C1	C2	H7	115.414
C1	C4	C5	60.264	C1	C4	H10	117.573
C1	C4	H11	116.979	C1	C5	C4	60.264
C1	C5	H12	117.573	C1	C5	H13	116.979
C2	C1	C4	118.677	C2	C1	C5	118.677
C2	C1	H6	115.546	C2	C3	H8	121.825
C2	C3	H9	121.649	C3	C2	H7	119.570
C4	C1	H6	116.487	C4	C5	H12	118.084
C4	C5	H13	117.962	C5	C1	H6	116.487
C5	C4	H10	118.084	C5	C4	H11	117.962
H8	C3	H9	116.526	H10	C4	H11	115.084
H12	C5	H13	115.084

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)

using model chemistry: MP2=FULL/3-21G*

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=FULL/3-21G*

States and conformations

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)