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	hartrees
Energy at 0K
Energy at 298.15K
HF Energy	-139.201821
Nuclear repulsion energy	56.282543

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2512	2386	1.84
2	A₁	2161	2053	296.23
3	A₁	1113	1057	14.33
4	A₁	719	682	38.53
5	E	2600	2469	50.84
5	E	2600	2469	50.84
6	E	1151	1093	0.10
6	E	1151	1093	0.10
7	E	831	789	2.02
7	E	831	789	2.02
8	E	304	289	6.33
8	E	304	289	6.33

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.352
C2	0.000	0.000	0.186
O3	0.000	0.000	1.321
H4	0.000	1.166	-1.640
H5	1.010	-0.583	-1.640
H6	-1.010	-0.583	-1.640

	B1	C2	O3	H4	H5	H6
B1		1.5383	2.6728	1.2012	1.2012	1.2012
C2	1.5383		1.1345	2.1667	2.1667	2.1667
O3	2.6728	1.1345		3.1819	3.1819	3.1819
H4	1.2012	2.1667	3.1819		2.0200	2.0200
H5	1.2012	2.1667	3.1819	2.0200		2.0200
H6	1.2012	2.1667	3.1819	2.0200	2.0200

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.858
C2	B1	H5	103.858	C2	B1	H6	103.858
H4	B1	H5	114.453	H4	B1	H6	114.453
H5	B1	H6	114.453

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

using model chemistry: MP2/aug-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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All results from a given calculation for BH3CO (Borane carbonyl)

using model chemistry: MP2/aug-cc-pVQZ

States and conformations

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