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	hartrees
Energy at 0K	-64.670130
Energy at 298.15K	-64.671339
HF Energy	-64.670130
Nuclear repulsion energy	23.928124

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3149	3149	7.51
2	A₁	2820	2820	26.12
3	A₁	1530	1530	62.34
4	A₁	1291	1291	6.51
5	B₁	741	741	104.98
6	B₁	654	654	2.62
7	B₂	3218	3218	0.24
8	B₂	907	907	54.47
9	B₂	423	423	2.78

Atom	y (Å)	z (Å)
C1	0.000	0.590
B2	0.000	-0.786
H3	0.917	1.175
H4	-0.917	1.175
H5	0.000	-1.962

	C1	B2	H3	H4	H5
C1		1.3762	1.0871	1.0871	2.5521
B2	1.3762		2.1642	2.1642	1.1759
H3	1.0871	2.1642		1.8336	3.2676
H4	1.0871	2.1642	1.8336		3.2676
H5	2.5521	1.1759	3.2676	3.2676

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	B2	H5	180.000		B2	C1	H3	122.507
B2	C1	H4	122.507		H4	C1	H3	114.987

All results from a given calculation for CH₂BH (methyleneborane)

using model chemistry: wB97X-D/6-311G*

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	-0.798
2	B	0.180
3	H	0.228
4	H	0.228
5	H	0.161

	x	y	z	Total
	0.000	0.000	-0.555	0.555
CHELPG
AIM
ESP

<r²>	21.589
(<r²>)^1/2	4.646

All results from a given calculation for CH2BH (methyleneborane)

using model chemistry: wB97X-D/6-311G*

States and conformations

All results from a given calculation for CH₂BH (methyleneborane)