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	hartrees
Energy at 0K	-154.897890
Energy at 298.15K	-154.903930
Nuclear repulsion energy	110.068528

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3303	2982	14.95
2	A₁	3277	2958	17.07
3	A₁	2000	1805	5.23
4	A₁	1624	1466	0.77
5	A₁	1571	1418	0.06
6	A₁	1176	1061	0.05
7	A₁	1142	1031	4.73
8	A₁	806	728	9.38
9	A₂	3347	3021	0.00
10	A₂	1280	1155	0.00
11	A₂	1044	942	0.00
12	A₂	673	608	0.00
13	B₁	3361	3033	29.01
14	B₁	1205	1087	1.31
15	B₁	1046	944	44.60
16	B₁	820	740	0.77
17	B₁	338	305	3.92
18	B₂	3385	3056	17.15
19	B₂	3272	2953	23.94
20	B₂	1582	1428	0.36
21	B₂	1249	1128	8.65
22	B₂	1206	1088	1.42
23	B₂	979	884	16.09
24	B₂	386	349	0.12

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.626
C2	0.000	0.000	0.318
H3	0.000	0.920	2.186
H4	0.000	-0.920	2.186
C5	0.000	0.764	-0.928
C6	0.000	-0.764	-0.928
H7	0.906	1.266	-1.226
H8	-0.906	1.266	-1.226
H9	-0.906	-1.266	-1.226
H10	0.906	-1.266	-1.226

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10
C1		1.3078	1.0764	1.0764	2.6658	2.6658	3.2495	3.2495	3.2495	3.2495
C2	1.3078		2.0814	2.0814	1.4616	1.4616	2.1928	2.1928	2.1928	2.1928
H3	1.0764	2.0814		1.8391	3.1175	3.5394	3.5472	3.5472	4.1518	4.1518
H4	1.0764	2.0814	1.8391		3.5394	3.1175	4.1518	4.1518	3.5472	3.5472
C5	2.6658	1.4616	3.1175	3.5394		1.5273	1.0776	1.0776	2.2422	2.2422
C6	2.6658	1.4616	3.5394	3.1175	1.5273		2.2422	2.2422	1.0776	1.0776
H7	3.2495	2.1928	3.5472	4.1518	1.0776	2.2422		1.8112	3.1126	2.5313
H8	3.2495	2.1928	3.5472	4.1518	1.0776	2.2422	1.8112		2.5313	3.1126
H9	3.2495	2.1928	4.1518	3.5472	2.2422	1.0776	3.1126	2.5313		1.8112
H10	3.2495	2.1928	4.1518	3.5472	2.2422	1.0776	2.5313	3.1126	1.8112

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C5	148.503	C1	C2	C6	148.503
C2	C1	H3	121.319	C2	C1	H4	121.319
C2	C5	C6	58.503	C2	C5	H7	118.661
C2	C5	H8	118.661	C2	C6	C5	58.503
C2	C6	H9	118.661	C2	C6	H10	118.661
H3	C1	H4	117.363	C5	C2	C6	62.993
C5	C6	H9	117.767	C5	C6	H10	117.767
C6	C5	H7	117.767	C6	C5	H8	117.767
H7	C5	H8	114.357	H9	C6	H10	114.357

All results from a given calculation for C₄H₆ (Methylenecyclopropane)

using model chemistry: HF/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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Number	Element	Mulliken	CHELPG
1	C	-0.341	-0.526
2	C	0.084	0.220
3	H	0.129	0.178
4	H	0.129	0.178
5	C	-0.287	-0.236
6	C	-0.287	-0.236
7	H	0.144	0.105
8	H	0.144	0.105
9	H	0.144	0.105
10	H	0.144	0.105

<r²>	76.149
(<r²>)^1/2	8.726

All results from a given calculation for C4H6 (Methylenecyclopropane)

using model chemistry: HF/6-31G**

States and conformations

All results from a given calculation for C₄H₆ (Methylenecyclopropane)