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	hartrees
Energy at 0K	-155.876989
Energy at 298.15K	-155.882587
Nuclear repulsion energy	108.068822

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3042	3047	15.01
2	A₁	3014	3019	15.63
3	A₁	1777	1780	5.47
4	A₁	1421	1424	0.07
5	A₁	1380	1382	0.06
6	A₁	1029	1030	2.53
7	A₁	986	988	2.11
8	A₁	711	712	3.38
9	A₂	3088	3093	0.00
10	A₂	1116	1117	0.00
11	A₂	918	919	0.00
12	A₂	589	590	0.00
13	B₁	3101	3106	20.72
14	B₁	1044	1046	0.78
15	B₁	872	874	27.81
16	B₁	723	724	1.80
17	B₁	277	277	2.36
18	B₂	3129	3134	16.13
19	B₂	3014	3018	18.18
20	B₂	1378	1380	0.77
21	B₂	1103	1104	6.09
22	B₂	1016	1018	0.48
23	B₂	870	871	12.07
24	B₂	342	343	0.18

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.654
C2	0.000	0.000	0.319
H3	0.000	0.941	2.226
H4	0.000	-0.941	2.226
C5	0.000	0.779	-0.941
C6	0.000	-0.779	-0.941
H7	0.926	1.293	-1.249
H8	-0.926	1.293	-1.249
H9	-0.926	-1.293	-1.249
H10	0.926	-1.293	-1.249

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10
C1		1.3350	1.1010	1.1010	2.7097	2.7097	3.3100	3.3100	3.3100	3.3100
C2	1.3350		2.1262	2.1262	1.4816	1.4816	2.2331	2.2331	2.2331	2.2331
H3	1.1010	2.1262		1.8821	3.1711	3.6038	3.6131	3.6131	4.2332	4.2332
H4	1.1010	2.1262	1.8821		3.6038	3.1711	4.2332	4.2332	3.6131	3.6131
C5	2.7097	1.4816	3.1711	3.6038		1.5575	1.1026	1.1026	2.2896	2.2896
C6	2.7097	1.4816	3.6038	3.1711	1.5575		2.2896	2.2896	1.1026	1.1026
H7	3.3100	2.2331	3.6131	4.2332	1.1026	2.2896		1.8513	3.1797	2.5852
H8	3.3100	2.2331	3.6131	4.2332	1.1026	2.2896	1.8513		2.5852	3.1797
H9	3.3100	2.2331	4.2332	3.6131	2.2896	1.1026	3.1797	2.5852		1.8513
H10	3.3100	2.2331	4.2332	3.6131	2.2896	1.1026	2.5852	3.1797	1.8513

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C5	148.290	C1	C2	C6	148.290
C2	C1	H3	121.276	C2	C1	H4	121.276
C2	C5	C6	58.290	C2	C5	H7	118.844
C2	C5	H8	118.844	C2	C6	C5	58.290
C2	C6	H9	118.844	C2	C6	H10	118.844
H3	C1	H4	117.449	C5	C2	C6	63.420
C5	C6	H9	117.779	C5	C6	H10	117.779
C6	C5	H7	117.779	C6	C5	H8	117.779
H7	C5	H8	114.189	H9	C6	H10	114.189

All results from a given calculation for C₄H₆ (Methylenecyclopropane)

using model chemistry: BLYP/cc-pVDZ

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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Number	Element	Mulliken
1	C	0.005
2	C	-0.085
3	H	-0.004
4	H	-0.004
5	C	-0.001
6	C	-0.001
7	H	0.022
8	H	0.022
9	H	0.022
10	H	0.022

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C4H6 (Methylenecyclopropane)

using model chemistry: BLYP/cc-pVDZ

States and conformations

All results from a given calculation for C₄H₆ (Methylenecyclopropane)