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	hartrees
Energy at 0K	-225.278851
Energy at 298.15K	-225.280131
HF Energy	-225.278851
Nuclear repulsion energy	61.716022

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2685	2564	103.98
2	A₁	1171	1118	132.87
3	A₁	536	512	23.59
4	B₁	917	875	79.37
5	B₂	1423	1359	439.77
6	B₂	1087	1038	0.14

Atom	y (Å)	z (Å)
B1	0.000	0.456
H2	0.000	1.646
F3	1.129	-0.218
F4	-1.129	-0.218

	B1	H2	F3	F4
B1		1.1899	1.3153	1.3153
H2	1.1899		2.1795	2.1795
F3	1.3153	2.1795		2.2587
F4	1.3153	2.1795	2.2587

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	B1	F3	120.840		H2	B1	F4	120.840
F3	B1	F4	118.320

All results from a given calculation for BHF₂ (Difluoroborane)

using model chemistry: wB97X-D/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	B	0.465
2	H	-0.042
3	F	-0.212
4	F	-0.212

	x	y	z	Total
	0.000	0.000	0.969	0.969
CHELPG
AIM
ESP

<r²>	37.745
(<r²>)^1/2	6.144

All results from a given calculation for BHF2 (Difluoroborane)

using model chemistry: wB97X-D/TZVP

States and conformations

All results from a given calculation for BHF₂ (Difluoroborane)