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	hartrees
Energy at 0K	-2861.818178
Energy at 298.15K	-2861.824183
HF Energy	-2861.818178
Nuclear repulsion energy	150.522578

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2175	2150	48.22
2	A₁	869	859	270.82
3	A₁	425	420	39.51
4	E	2201	2175	66.39
4	E	2201	2175	66.39
5	E	891	881	41.31
5	E	891	881	41.31
6	E	594	587	14.15
6	E	594	587	14.15

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	-1.468
Br2	0.000	0.000	0.753
H3	0.000	1.418	-1.937
H4	1.228	-0.709	-1.937
H5	-1.228	-0.709	-1.937

	Si1	Br2	H3	H4	H5
Si1		2.2213	1.4939	1.4939	1.4939
Br2	2.2213		3.0413	3.0413	3.0413
H3	1.4939	3.0413		2.4568	2.4568
H4	1.4939	3.0413	2.4568		2.4568
H5	1.4939	3.0413	2.4568	2.4568

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	Si1	H3	108.294	Br2	Si1	H4	108.294
Br2	Si1	H5	108.294	H3	Si1	H4	110.623
H3	Si1	H5	110.623	H4	Si1	H5	110.623

All results from a given calculation for SiH₃Br (bromosilane)

using model chemistry: LSDA/TZVP

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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Number	Element	Mulliken
1	Si	0.251
2	Br	-0.210
3	H	-0.014
4	H	-0.014
5	H	-0.014

	x	y	z	Total
	0.000	0.000	-1.513	1.513
CHELPG
AIM
ESP

<r²>	87.868
(<r²>)^1/2	9.374

All results from a given calculation for SiH3Br (bromosilane)

using model chemistry: LSDA/TZVP

States and conformations

All results from a given calculation for SiH₃Br (bromosilane)