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	hartrees
Energy at 0K	-139.799848
Energy at 298.15K
HF Energy	-139.191337
Nuclear repulsion energy	56.390157

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2477	2477
2	A₁	2197	2197
3	A₁	1104	1104
4	A₁	707	707
5	E	2555	2555
5	E	2554	2554
6	E	1138	1138
6	E	1138	1138
7	E	836	836
7	E	835	835
8	E	306	306
8	E	304	304

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.355
C2	0.000	0.000	0.191
O3	0.000	0.000	1.321
H4	0.000	1.169	-1.646
H5	1.012	-0.584	-1.646
H6	-1.012	-0.584	-1.646

	B1	C2	O3	H4	H5	H6
B1		1.5455	2.6756	1.2045	1.2045	1.2045
C2	1.5455		1.1301	2.1771	2.1771	2.1771
O3	2.6756	1.1301		3.1888	3.1888	3.1888
H4	1.2045	2.1771	3.1888		2.0242	2.0242
H5	1.2045	2.1771	3.1888	2.0242		2.0242
H6	1.2045	2.1771	3.1888	2.0242	2.0242

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	104.000
C2	B1	H5	104.000	C2	B1	H6	104.000
H4	B1	H5	114.344	H4	B1	H6	114.344
H5	B1	H6	114.344

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

using model chemistry: QCISD(T)=FULL/6-311+G(3df,2p)

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(T)=FULL/6-311+G(3df,2p)

States and conformations

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