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	hartrees
Energy at 0K	-32.632365
Energy at 298.15K	-32.640479
HF Energy	-32.028212
Nuclear repulsion energy	87.446930

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3297	3131	24.75
2	A'	3287	3121	22.20
3	A'	3202	3040	9.88
4	A'	3197	3035	5.18
5	A'	3184	3023	13.93
6	A'	3177	3016	10.20
7	A'	1706	1620	19.52
8	A'	1544	1466	1.71
9	A'	1486	1411	0.31
10	A'	1368	1299	0.91
11	A'	1319	1252	2.32
12	A'	1258	1194	4.78
13	A'	1239	1176	1.41
14	A'	1072	1017	5.15
15	A'	1003	952	8.62
16	A'	977	927	37.81
17	A'	833	791	2.65
18	A'	784	744	0.75
19	A'	439	417	1.12
20	A'	270	256	1.25
21	A"	3285	3119	0.05
22	A"	3178	3017	21.14
23	A"	1490	1415	1.71
24	A"	1205	1144	1.00
25	A"	1144	1086	7.48
26	A"	1065	1011	8.57
27	A"	1018	967	29.66
28	A"	936	889	7.58
29	A"	846	803	42.90
30	A"	840	798	23.97
31	A"	684	650	10.19
32	A"	313	298	1.90
33	A"	117	111	0.14

Atom	x (Å)	y (Å)	z (Å)
C1	-0.400	0.294	0.000
C2	0.265	-1.043	0.000
C3	-0.414	-2.235	0.000
C4	0.265	1.447	0.764
C5	0.265	1.447	-0.764
H6	-1.498	0.272	0.000
H7	1.365	-1.045	0.000
H8	0.122	-3.191	0.000
H9	-1.509	-2.265	0.000
H10	-0.392	2.159	1.277
H11	1.209	1.228	1.276
H12	-0.392	2.159	-1.277
H13	1.209	1.228	-1.276

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.4930	2.5288	1.5352	1.5352	1.0973	2.2155	3.5238	2.7887	2.2601	2.2561	2.2601	2.2561
C2	1.4930		1.3718	2.6043	2.6043	2.1987	1.0995	2.1531	2.1544	3.5086	2.7702	3.5086	2.7702
C3	2.5288	1.3718		3.8211	3.8211	2.7311	2.1394	1.0960	1.0958	4.5755	4.0313	4.5755	4.0313
C4	1.5352	2.6043	3.8211		1.5290	2.2520	2.8291	4.7026	4.1845	1.0956	1.0955	2.2593	2.2586
C5	1.5352	2.6043	3.8211	1.5290		2.2520	2.8291	4.7026	4.1845	2.2593	2.2586	1.0956	1.0955
H6	1.0973	2.1987	2.7311	2.2520	2.2520		3.1505	3.8229	2.5370	2.5325	3.1410	2.5325	3.1410
H7	2.2155	1.0995	2.1394	2.8291	2.8291	3.1505		2.4794	3.1217	3.8704	2.6114	3.8704	2.6114
H8	3.5238	2.1531	1.0960	4.7026	4.7026	3.8229	2.4794		1.8757	5.5240	4.7260	5.5240	4.7260
H9	2.7887	2.1544	1.0958	4.1845	4.1845	2.5370	3.1217	1.8757		4.7381	4.6060	4.7381	4.6060
H10	2.2601	3.5086	4.5755	1.0956	2.2593	2.5325	3.8704	5.5240	4.7381		1.8514	2.5533	3.1532
H11	2.2561	2.7702	4.0313	1.0955	2.2586	3.1410	2.6114	4.7260	4.6060	1.8514		3.1532	2.5515
H12	2.2601	3.5086	4.5755	2.2593	1.0956	2.5325	3.8704	5.5240	4.7381	2.5533	3.1532		1.8514
H13	2.2561	2.7702	4.0313	2.2586	1.0955	3.1410	2.6114	4.7260	4.6060	3.1532	2.5515	1.8514

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.885	C1	C2	H7	116.604
C1	C4	C5	60.133	C1	C4	H10	117.459
C1	C4	H11	117.115	C1	C5	C4	60.133
C1	C5	H12	117.459	C1	C5	H13	117.115
C2	C1	C4	118.630	C2	C1	C5	118.630
C2	C1	H6	115.321	C2	C3	H8	121.087
C2	C3	H9	121.225	C3	C2	H7	119.511
C4	C1	H6	116.643	C4	C5	H12	117.872
C4	C5	H13	117.821	C5	C1	H6	116.643
C5	C4	H10	117.872	C5	C4	H11	117.821
H8	C3	H9	117.689	H10	C4	H11	115.340
H12	C5	H13	115.340

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)

using model chemistry: MP2/CEP-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/CEP-31G*

States and conformations

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)