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	hartrees
Energy at 0K	-64.589818
Energy at 298.15K	-64.591004
HF Energy	-64.589818
Nuclear repulsion energy	23.857948

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3183	3027	9.83
2	A₁	2861	2721	24.33
3	A₁	1536	1461	52.06
4	A₁	1293	1229	5.17
5	B₁	733	697	80.16
6	B₁	633	602	12.85
7	B₂	3252	3093	0.84
8	B₂	921	876	51.21
9	B₂	418	397	4.20

Atom	y (Å)	z (Å)
C1	0.000	0.593
B2	0.000	-0.789
H3	0.918	1.177
H4	-0.918	1.177
H5	0.000	-1.968

	C1	B2	H3	H4	H5
C1		1.3818	1.0883	1.0883	2.5607
B2	1.3818		2.1697	2.1697	1.1789
H3	1.0883	2.1697		1.8368	3.2760
H4	1.0883	2.1697	1.8368		3.2760
H5	2.5607	1.1789	3.2760	3.2760

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	B2	H5	180.000		B2	C1	H3	122.449
B2	C1	H4	122.449		H4	C1	H3	115.102

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	-0.564
2	B	0.126
3	H	0.190
4	H	0.190
5	H	0.057

	x	y	z	Total
	0.000	0.000	-0.445	0.445
CHELPG
AIM
ESP

<r²>	21.403
(<r²>)^1/2	4.626

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)