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	hartrees
Energy at 0K	-139.591959
Energy at 298.15K
HF Energy	-139.153858
Nuclear repulsion energy	55.637077

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2487	2487	8.79
2	A₁	2216	2216	282.95
3	A₁	1118	1118	30.33
4	A₁	650	650	18.69
5	E	2573	2573	71.59
5	E	2573	2573	71.59
6	E	1151	1151	0.22
6	E	1151	1151	0.22
7	E	850	850	0.30
7	E	850	850	0.30
8	E	304	304	12.40
8	E	304	304	12.40

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.385
C2	0.000	0.000	0.203
O3	0.000	0.000	1.339
H4	0.000	1.185	-1.669
H5	1.027	-0.593	-1.669
H6	-1.027	-0.593	-1.669

	B1	C2	O3	H4	H5	H6
B1		1.5881	2.7241	1.2189	1.2189	1.2189
C2	1.5881		1.1360	2.2161	2.2161	2.2161
O3	2.7241	1.1360		3.2335	3.2335	3.2335
H4	1.2189	2.2161	3.2335		2.0530	2.0530
H5	1.2189	2.2161	3.2335	2.0530		2.0530
H6	1.2189	2.2161	3.2335	2.0530	2.0530

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.491
C2	B1	H5	103.491	C2	B1	H6	103.491
H4	B1	H5	114.731	H4	B1	H6	114.731
H5	B1	H6	114.731

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

using model chemistry: QCISD/cc-pCVDZ

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/cc-pCVDZ

States and conformations

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