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	hartrees
Energy at 0K	-139.718914
Energy at 298.15K
HF Energy	-139.194564
Nuclear repulsion energy	56.259925

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2483	2390	3.89
2	A₁	2225	2141	342.17
3	A₁	1122	1080	23.74
4	A₁	676	651	26.40
5	E	2562	2466	65.66
5	E	2562	2466	65.66
6	E	1156	1113	0.37
6	E	1156	1113	0.37
7	E	851	819	1.28
7	E	851	819	1.28
8	E	310	298	9.42
8	E	310	298	9.42

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.365
C2	0.000	0.000	0.196
O3	0.000	0.000	1.324
H4	0.000	1.171	-1.650
H5	1.014	-0.585	-1.650
H6	-1.014	-0.585	-1.650

	B1	C2	O3	H4	H5	H6
B1		1.5610	2.6890	1.2051	1.2051	1.2051
C2	1.5610		1.1280	2.1859	2.1859	2.1859
O3	2.6890	1.1280		3.1961	3.1961	3.1961
H4	1.2051	2.1859	3.1961		2.0281	2.0281
H5	1.2051	2.1859	3.1961	2.0281		2.0281
H6	1.2051	2.1859	3.1961	2.0281	2.0281

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.675
C2	B1	H5	103.675	C2	B1	H6	103.675
H4	B1	H5	114.593	H4	B1	H6	114.593
H5	B1	H6	114.593

All results from a given calculation for BH₃CO (Borane carbonyl)

using model chemistry: QCISD/aug-cc-pVTZ

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 BH3CO (Borane carbonyl)

using model chemistry: QCISD/aug-cc-pVTZ

States and conformations

All results from a given calculation for BH₃CO (Borane carbonyl)