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	hartrees
Energy at 0K	-10.166049
Energy at 298.15K	-10.167219
HF Energy	-10.166049
Nuclear repulsion energy	12.585107

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3175	3175	3.39
2	A₁	2817	2817	34.13
3	A₁	1517	1517	73.30
4	A₁	1276	1276	3.87
5	B₁	742	742	121.72
6	B₁	636	636	9.66
7	B₂	3258	3258	1.26
8	B₂	915	915	45.44
9	B₂	400	400	6.60

Atom	y (Å)	z (Å)
C1	0.000	0.605
B2	0.000	-0.802
H3	0.929	1.186
H4	-0.929	1.186
H5	0.000	-1.987

	C1	B2	H3	H4	H5
C1		1.4069	1.0957	1.0957	2.5918
B2	1.4069		2.1944	2.1944	1.1849
H3	1.0957	2.1944		1.8576	3.3062
H4	1.0957	2.1944	1.8576		3.3062
H5	2.5918	1.1849	3.3062	3.3062

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	B2	H5	180.000		B2	C1	H3	122.041
B2	C1	H4	122.041		H4	C1	H3	115.918

All results from a given calculation for CH₂BH (methyleneborane)

using model chemistry: wB97X-D/CEP-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	-0.151
2	B	-0.457
3	H	0.211
4	H	0.211
5	H	0.186

	x	y	z	Total
	0.000	0.000	-0.616	0.616
CHELPG
AIM
ESP

<r²>	19.780
(<r²>)^1/2	4.448

All results from a given calculation for CH2BH (methyleneborane)

using model chemistry: wB97X-D/CEP-31G*

States and conformations

All results from a given calculation for CH₂BH (methyleneborane)