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	hartrees
Energy at 0K	-139.628409
Energy at 298.15K
HF Energy	-139.156448
Nuclear repulsion energy	56.275284

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	2550	2408	2.68	168.41	0.00	0.00
2	A₁	2182	2061	256.24	113.76	0.26	0.41
3	A₁	1127	1065	11.66	23.62	0.52	0.69
4	A₁	718	678	35.98	0.52	0.05	0.10
5	E	2643	2497	34.82	91.33	0.75	0.86
5	E	2643	2497	34.82	91.33	0.75	0.86
6	E	1166	1101	0.05	19.95	0.75	0.86
6	E	1166	1101	0.05	19.95	0.75	0.86
7	E	850	803	3.51	0.09	0.75	0.86
7	E	850	803	3.51	0.09	0.75	0.86
8	E	314	296	7.02	0.19	0.75	0.86
8	E	314	296	7.02	0.19	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.356
C2	0.000	0.000	0.187
O3	0.000	0.000	1.324
H4	0.000	1.167	-1.645
H5	1.010	-0.583	-1.645
H6	-1.010	-0.583	-1.645

	B1	C2	O3	H4	H5	H6
B1		1.5421	2.6798	1.2021	1.2021	1.2021
C2	1.5421		1.1377	2.1717	2.1717	2.1717
O3	2.6798	1.1377		3.1904	3.1904	3.1904
H4	1.2021	2.1717	3.1904		2.0208	2.0208
H5	1.2021	2.1717	3.1904	2.0208		2.0208
H6	1.2021	2.1717	3.1904	2.0208	2.0208

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.939
C2	B1	H5	103.939	C2	B1	H6	103.939
H4	B1	H5	114.391	H4	B1	H6	114.391
H5	B1	H6	114.391

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

using model chemistry: MP2/6-31G(2df,p)

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: MP2/6-31G(2df,p)

States and conformations

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