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	hartrees
Energy at 0K	-224.348822
Energy at 298.15K	-224.350168
Nuclear repulsion energy	62.688203

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2792	2537	124.57
2	A₁	1241	1127	153.91
3	A₁	577	525	27.23
4	B₁	1004	912	103.84
5	B₂	1509	1371	449.06
6	B₂	1184	1076	0.85

Atom	y (Å)	z (Å)
B1	0.000	0.451
H2	0.000	1.631
F3	1.112	-0.216
F4	-1.112	-0.216

	B1	H2	F3	F4
B1		1.1804	1.2961	1.2961
H2	1.1804		2.1556	2.1556
F3	1.2961	2.1556		2.2231
F4	1.2961	2.1556	2.2231

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	B1	F3	120.948		H2	B1	F4	120.948
F3	B1	F4	118.103

All results from a given calculation for BHF₂ (Difluoroborane)

using model chemistry: HF/6-311+G(3df,2p)

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	B	-0.073
2	H	0.133
3	F	-0.030
4	F	-0.030

	x	y	z	Total
	0.000	0.000	1.066	1.066
CHELPG
AIM
ESP

<r²>	36.856
(<r²>)^1/2	6.071

All results from a given calculation for BHF2 (Difluoroborane)

using model chemistry: HF/6-311+G(3df,2p)

States and conformations

All results from a given calculation for BHF₂ (Difluoroborane)