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	hartrees
Energy at 0K	-139.351804
Energy at 298.15K
HF Energy	-139.054829
Nuclear repulsion energy	55.038934

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	2500	2375	5.13	191.72	0.00	0.00
2	A₁	2014	1913	208.74	159.00	0.29	0.45
3	A₁	1152	1094	9.93	48.72	0.56	0.72
4	A₁	665	631	30.41	0.75	0.66	0.80
5	E	2575	2447	65.06	109.15	0.75	0.86
5	E	2575	2447	65.06	109.15	0.75	0.86
6	E	1165	1107	0.12	31.41	0.75	0.86
6	E	1165	1107	0.12	31.41	0.75	0.86
7	E	869	826	0.00	0.35	0.75	0.86
7	E	869	826	0.00	0.35	0.75	0.86
8	E	287	273	12.70	0.46	0.75	0.86
8	E	287	273	12.70	0.46	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.382
C2	0.000	0.000	0.187
O3	0.000	0.000	1.358
H4	0.000	1.173	-1.694
H5	1.015	-0.586	-1.694
H6	-1.015	-0.586	-1.694

	B1	C2	O3	H4	H5	H6
B1		1.5687	2.7398	1.2134	1.2134	1.2134
C2	1.5687		1.1711	2.2166	2.2166	2.2166
O3	2.7398	1.1711		3.2697	3.2697	3.2697
H4	1.2134	2.2166	3.2697		2.0309	2.0309
H5	1.2134	2.2166	3.2697	2.0309		2.0309
H6	1.2134	2.2166	3.2697	2.0309	2.0309

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	104.916
C2	B1	H5	104.916	C2	B1	H6	104.916
H4	B1	H5	113.617	H4	B1	H6	113.617
H5	B1	H6	113.617

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)