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	hartrees
Energy at 0K
Energy at 298.15K	0.091378
HF Energy	0.091378
Nuclear repulsion energy	69.458609

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3289	3204	74.66	20.68	0.42	0.59
2	A'	3159	3076	1.56	148.26	0.00	0.01
3	A'	3100	3020	0.00	88.05	0.16	0.27
4	A'	3076	2996	0.65	104.73	0.73	0.84
5	A'	2088	2033	1.99	244.85	0.22	0.36
6	A'	1429	1392	4.65	26.29	0.62	0.76
7	A'	1394	1357	0.77	52.26	0.62	0.77
8	A'	1380	1344	1.40	52.69	0.67	0.80
9	A'	1314	1280	0.40	58.26	0.74	0.85
10	A'	1229	1197	2.08	21.76	0.53	0.69
11	A'	1117	1088	2.85	1.61	0.68	0.81
12	A'	1017	991	5.34	5.02	0.24	0.39
13	A'	939	914	1.97	9.87	0.75	0.85
14	A'	803	782	0.51	31.09	0.69	0.82
15	A'	342	333	0.47	0.19	0.75	0.85
16	A"	3064	2984	0.54	120.19	0.75	0.86
17	A"	3054	2975	0.27	77.88	0.75	0.86
18	A"	1380	1344	0.66	53.05	0.75	0.86
19	A"	1018	992	15.15	3.28	0.75	0.86
20	A"	987	961	16.00	34.30	0.75	0.86
21	A"	877	854	2.30	32.99	0.75	0.86
22	A"	809	788	32.46	0.48	0.75	0.86
23	A"	354	345	11.88	8.47	0.75	0.86
24	A"	69	67	0.20	0.30	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.184	0.000
C2	-0.144	-1.293	0.000
C3	1.117	-0.510	0.000
C4	-0.719	1.438	0.000
H5	-0.478	-1.830	0.897
H6	-0.478	-1.830	-0.897
H7	2.188	-0.574	0.000
H8	-0.034	2.295	0.000
H9	-1.362	1.511	-0.888
H10	-1.362	1.511	0.888

	C1	C2	C3	C4	H5	H6	H7	H8	H9	H10
C1		1.4843	1.3152	1.4454	2.2560	2.2560	2.3156	2.1114	2.0986	2.0986
C2	1.4843		1.4845	2.7911	1.0975	1.0975	2.4406	3.5901	3.1838	3.1838
C3	1.3152	1.4845		2.6770	2.2564	2.2564	1.0728	3.0324	3.3195	3.3195
C4	1.4454	2.7911	2.6770		3.3974	3.3974	3.5352	1.0971	1.0984	1.0984
H5	2.2560	1.0975	2.2564	3.3974		1.7945	3.0807	4.2448	3.8899	3.4562
H6	2.2560	1.0975	2.2564	3.3974	1.7945		3.0807	4.2448	3.4562	3.8899
H7	2.3156	2.4406	1.0728	3.5352	3.0807	3.0807		3.6291	4.2116	4.2116
H8	2.1114	3.5901	3.0324	1.0971	4.2448	4.2448	3.6291		1.7789	1.7789
H9	2.0986	3.1838	3.3195	1.0984	3.8899	3.4562	4.2116	1.7789		1.7752
H10	2.0986	3.1838	3.3195	1.0984	3.4562	3.8899	4.2116	1.7789	1.7752

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C3	52.593	H1	C2	C6	121.079
C2	C3	C6	24.616	C2	C3	C10	71.750
C2	C6	C3	34.293	C2	C6	H4	48.342
C2	C6	H5	35.163	C3	C2	C6	121.091
C3	C6	H4	51.865	C3	C6	H5	66.569
C3	C10	H7	9.143	C3	C10	H8	65.017
C3	C10	H9	74.491	H4	C6	H5	74.687
C6	C3	C10	86.252	H7	C10	H8	58.936
H7	C10	H9	77.833	H8	C10	H9	60.069

All results from a given calculation for C₄H₆ (1-Methylcyclopropene)

using model chemistry: PM3

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 C4H6 (1-Methylcyclopropene)

using model chemistry: PM3

States and conformations

All results from a given calculation for C₄H₆ (1-Methylcyclopropene)