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	hartrees
Energy at 0K	-139.446194
Energy at 298.15K	-139.448713
HF Energy	-139.164706
Nuclear repulsion energy	53.373297

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3076	2943	0.80
2	A₁	1909	1827	69.72
3	A₁	1447	1384	27.43
4	A₁	812	777	0.00
5	E	3164	3028	3.95
5	E	3164	3028	3.95
6	E	1539	1472	9.62
6	E	1539	1472	9.62
7	E	988	945	24.57
7	E	988	945	24.57
8	E	341	326	8.71
8	E	341	326	8.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.314
B2	0.000	0.000	0.235
O3	0.000	0.000	1.477
H4	0.000	1.027	-1.703
H5	0.889	-0.513	-1.703
H6	-0.889	-0.513	-1.703

	C1	B2	O3	H4	H5	H6
C1		1.5484	2.7911	1.0980	1.0980	1.0980
B2	1.5484		1.2427	2.1929	2.1929	2.1929
O3	2.7911	1.2427		3.3420	3.3420	3.3420
H4	1.0980	2.1929	3.3420		1.7783	1.7783
H5	1.0980	2.1929	3.3420	1.7783		1.7783
H6	1.0980	2.1929	3.3420	1.7783	1.7783

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.764
B2	C1	H5	110.764	B2	C1	H6	110.764
H4	C1	H5	108.148	H4	C1	H6	108.148
H5	C1	H6	108.148

All results from a given calculation for CH₃BO (Borane, methyloxo-)

using model chemistry: MP2/6-31G

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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All results from a given calculation for CH3BO (Borane, methyloxo-)

using model chemistry: MP2/6-31G

States and conformations

All results from a given calculation for CH₃BO (Borane, methyloxo-)