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	hartrees
Energy at 0K	-945.863459
Energy at 298.15K	-945.864354
Nuclear repulsion energy	108.243312

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2765	2658	74.01
2	A₁	658	633	39.54
3	A₁	275	264	1.66
4	B₁	767	737	8.25
5	B₂	1062	1021	145.33
6	B₂	853	820	271.41

Atom	y (Å)	z (Å)
B1	0.000	0.718
H2	0.000	1.897
Cl3	1.564	-0.161
Cl4	-1.564	-0.161

	B1	H2	Cl3	Cl4
B1		1.1791	1.7941	1.7941
H2	1.1791		2.5851	2.5851
Cl3	1.7941	2.5851		3.1276
Cl4	1.7941	2.5851	3.1276

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	B1	Cl3	119.351		H2	B1	Cl4	119.351
Cl3	B1	Cl4	121.299

All results from a given calculation for BHCl₂ (Borane, dichloro-)

using model chemistry: B3LYP/SDD

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	B	-0.105
2	H	0.167
3	Cl	-0.031
4	Cl	-0.031

	x	y	z	Total
	0.000	0.000	0.992	0.992
CHELPG
AIM
ESP

<r²>	110.264
(<r²>)^1/2	10.501

All results from a given calculation for BHCl2 (Borane, dichloro-)

using model chemistry: B3LYP/SDD

States and conformations

All results from a given calculation for BHCl₂ (Borane, dichloro-)