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	hartrees
Energy at 0K	-64.579633
Energy at 298.15K	-64.580924
HF Energy	-64.579633
Nuclear repulsion energy	23.835574

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3183	3045	10.59
2	A₁	2857	2733	24.61
3	A₁	1531	1465	56.69
4	A₁	1322	1265	6.24
5	B₁	795	760	128.88
6	B₁	671	642	0.07
7	B₂	3258	3117	0.28
8	B₂	936	895	58.31
9	B₂	476	456	5.68

Atom	y (Å)	z (Å)
C1	0.000	0.593
B2	0.000	-0.791
H3	0.916	1.181
H4	-0.916	1.181
H5	0.000	-1.968

	C1	B2	H3	H4	H5
C1		1.3845	1.0882	1.0882	2.5612
B2	1.3845		2.1743	2.1743	1.1767
H3	1.0882	2.1743		1.8320	3.2792
H4	1.0882	2.1743	1.8320		3.2792
H5	2.5612	1.1767	3.2792	3.2792

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	B2	H5	180.000		B2	C1	H3	122.674
B2	C1	H4	122.674		H4	C1	H3	114.652

All results from a given calculation for CH₂BH (methyleneborane)

using model chemistry: HSEh1PBE/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
1	C	-0.600
2	B	0.168
3	H	0.182
4	H	0.182
5	H	0.067

	x	y	z	Total
	0.000	0.000	-0.415	0.415
CHELPG
AIM
ESP

<r²>	21.479
(<r²>)^1/2	4.635

All results from a given calculation for CH2BH (methyleneborane)

using model chemistry: HSEh1PBE/6-31G

States and conformations

All results from a given calculation for CH₂BH (methyleneborane)