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	hartrees
Energy at 0K	-943.482245
Energy at 298.15K	-943.483205
Nuclear repulsion energy	111.868203

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2634	2604	52.56
2	A₁	741	733	22.58
3	A₁	285	282	0.74
4	B₁	741	733	5.28
5	B₂	1043	1031	265.12
6	B₂	897	887	106.08

Atom	y (Å)	z (Å)
B1	0.000	0.706
H2	0.000	1.910
Cl3	1.505	-0.160
Cl4	-1.505	-0.160

	B1	H2	Cl3	Cl4
B1		1.2039	1.7360	1.7360
H2	1.2039		2.5589	2.5589
Cl3	1.7360	2.5589		3.0093
Cl4	1.7360	2.5589	3.0093

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	B1	Cl3	119.920		H2	B1	Cl4	119.920
Cl3	B1	Cl4	120.160

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

using model chemistry: LSDA/aug-cc-pVDZ

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	-0.611
2	H	0.623
3	Cl	-0.006
4	Cl	-0.006

	x	y	z	Total
	0.000	0.000	0.422	0.422
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: LSDA/aug-cc-pVDZ

States and conformations

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