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	hartrees
Energy at 0K	-139.246042
Energy at 298.15K	-139.248148
HF Energy	-139.246042
Nuclear repulsion energy	55.107400

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3715	3676	133.20
2	A'	3099	3067	17.09
3	A'	1827	1808	325.36
4	A'	1276	1263	13.10
5	A'	959	949	171.17
6	A'	947	937	0.76
7	A'	598	592	103.75
8	A'	360	356	17.22
9	A"	3178	3145	3.56
10	A"	746	738	56.76
11	A"	613	606	81.20
12	A"	313	310	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.040	1.380	0.000
B2	0.040	0.001	0.000
O3	0.040	-1.310	0.000
H4	0.040	1.958	0.926
H5	0.040	1.958	-0.926
H6	-0.839	-1.727	0.000

	C1	B2	O3	H4	H5	H6
C1		1.3789	2.6900	1.0918	1.0918	3.2297
B2	1.3789		1.3110	2.1651	2.1651	1.9395
O3	2.6900	1.3110		3.3968	3.3968	0.9734
H4	1.0918	2.1651	3.3968		1.8524	3.9008
H5	1.0918	2.1651	3.3968	1.8524		3.9008
H6	3.2297	1.9395	0.9734	3.9008	3.9008

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	121.973
B2	C1	H5	121.973	B2	O3	H6	115.417
H4	C1	H5	116.054

All results from a given calculation for CH₂BOH (hydroxy(methylene)borane)

using model chemistry: SVWN/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	-0.624
2	B	0.280
3	O	-0.250
4	H	0.149
5	H	0.149
6	H	0.296

	x	y	z	Total
	-1.662	-1.782	0.000	2.437
CHELPG
AIM
ESP

	x	y	z
x	3.057	0.195	0.000
y	0.195	6.333	0.000
z	0.000	0.000	2.991

<r²>	49.148
(<r²>)^1/2	7.011

All results from a given calculation for CH2BOH (hydroxy(methylene)borane)

using model chemistry: SVWN/6-311G**

States and conformations

All results from a given calculation for CH₂BOH (hydroxy(methylene)borane)