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	hartrees
Energy at 0K	-64.251248
Energy at 298.15K	-64.252621
HF Energy	-64.251248
Nuclear repulsion energy	24.073513

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3273	2973	4.20
2	A₁	2924	2656	25.45
3	A₁	1601	1454	60.45
4	A₁	1379	1253	0.27
5	B₁	855	777	94.85
6	B₁	741	673	0.79
7	B₂	3340	3034	0.00
8	B₂	973	884	49.49
9	B₂	491	446	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.590
B2	0.000	-0.783
H3	0.910	1.162
H4	-0.910	1.162
H5	0.000	-1.949

	C1	B2	H3	H4	H5
C1		1.3723	1.0754	1.0754	2.5386
B2	1.3723		2.1476	2.1476	1.1663
H3	1.0754	2.1476		1.8202	3.2419
H4	1.0754	2.1476	1.8202		3.2419
H5	2.5386	1.1663	3.2419	3.2419

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	B2	H5	180.000		B2	C1	H3	122.189
B2	C1	H4	122.189		H4	C1	H3	115.623

All results from a given calculation for CH₂BH (methyleneborane)

using model chemistry: HF/cc-pVQZ

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	-0.446
2	B	0.294
3	H	0.110
4	H	0.110
5	H	-0.067

	x	y	z	Total
	0.000	0.000	-0.854	0.854
CHELPG
AIM
ESP

<r²>	21.611
(<r²>)^1/2	4.649

All results from a given calculation for CH2BH (methyleneborane)

using model chemistry: HF/cc-pVQZ

States and conformations

All results from a given calculation for CH₂BH (methyleneborane)