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	hartrees
Energy at 0K	-139.537988
Energy at 298.15K
HF Energy	-139.137128
Nuclear repulsion energy	55.929711

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2554	2407	3.29	169.89	0.00	0.00
2	A₁	2171	2046	257.36	129.57	0.28	0.44
3	A₁	1143	1077	8.03	31.24	0.57	0.72
4	A₁	714	673	36.60	0.10	0.03	0.06
5	E	2643	2490	45.27	96.28	0.75	0.86
5	E	2643	2490	45.27	96.28	0.75	0.86
6	E	1168	1101	0.05	25.71	0.75	0.86
6	E	1168	1101	0.05	25.71	0.75	0.86
7	E	858	808	1.40	0.09	0.75	0.86
7	E	858	808	1.40	0.09	0.75	0.86
8	E	308	291	10.53	0.36	0.75	0.86
8	E	308	291	10.53	0.36	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.362
C2	0.000	0.000	0.185
O3	0.000	0.000	1.333
H4	0.000	1.169	-1.656
H5	1.013	-0.585	-1.656
H6	-1.013	-0.585	-1.656

	B1	C2	O3	H4	H5	H6
B1		1.5471	2.6951	1.2058	1.2058	1.2058
C2	1.5471		1.1481	2.1815	2.1815	2.1815
O3	2.6951	1.1481		3.2102	3.2102	3.2102
H4	1.2058	2.1815	3.2102		2.0251	2.0251
H5	1.2058	2.1815	3.2102	2.0251		2.0251
H6	1.2058	2.1815	3.2102	2.0251	2.0251

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	104.144
C2	B1	H5	104.144	C2	B1	H6	104.144
H4	B1	H5	114.232	H4	B1	H6	114.232
H5	B1	H6	114.232

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

using model chemistry: MP2=FULL/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 BH3CO (Borane carbonyl)

using model chemistry: MP2=FULL/6-31G*

States and conformations

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