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	hartrees
Energy at 0K	-64.689599
Energy at 298.15K	-64.690773
HF Energy	-64.689599
Nuclear repulsion energy	23.787699

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3143	3049	11.82
2	A₁	2831	2746	18.53
3	A₁	1509	1464	47.72
4	A₁	1244	1206	7.68
5	B₁	723	701	70.50
6	B₁	628	609	2.21
7	B₂	3215	3118	2.06
8	B₂	911	883	36.07
9	B₂	405	393	3.12

Atom	y (Å)	z (Å)
C1	0.000	0.594
B2	0.000	-0.790
H3	0.925	1.180
H4	-0.925	1.180
H5	0.000	-1.972

	C1	B2	H3	H4	H5
C1		1.3834	1.0955	1.0955	2.5655
B2	1.3834		2.1763	2.1763	1.1822
H3	1.0955	2.1763		1.8506	3.2850
H4	1.0955	2.1763	1.8506		3.2850
H5	2.5655	1.1822	3.2850	3.2850

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	B2	H5	180.000		B2	C1	H3	122.366
B2	C1	H4	122.366		H4	C1	H3	115.267

All results from a given calculation for CH₂BH (methyleneborane)

using model chemistry: B3LYP/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	-0.071
2	B	-0.076
3	H	0.048
4	H	0.048
5	H	0.050

	x	y	z	Total
	0.000	0.000	-0.420	0.420
CHELPG
AIM
ESP

<r²>	21.711
(<r²>)^1/2	4.660

All results from a given calculation for CH2BH (methyleneborane)

using model chemistry: B3LYP/cc-pVDZ

States and conformations

All results from a given calculation for CH₂BH (methyleneborane)