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	hartrees
Energy at 0K	-225.232184
Energy at 298.15K	-225.233418
Nuclear repulsion energy	60.806023

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2669	2655	97.71
2	A₁	1106	1101	109.12
3	A₁	510	507	19.45
4	B₁	891	886	63.37
5	B₂	1340	1333	408.38
6	B₂	1056	1051	1.26

Atom	y (Å)	z (Å)
B1	0.000	0.467
H2	0.000	1.660
F3	1.148	-0.222
F4	-1.148	-0.222

	B1	H2	F3	F4
B1		1.1931	1.3382	1.3382
H2	1.1931		2.2038	2.2038
F3	1.3382	2.2038		2.2952
F4	1.3382	2.2038	2.2952

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	B1	F3	120.954		H2	B1	F4	120.954
F3	B1	F4	118.091

All results from a given calculation for BHF₂ (Difluoroborane)

using model chemistry: BLYP/6-31+G**

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	0.670
2	H	-0.033
3	F	-0.318
4	F	-0.318

	x	y	z	Total
	0.000	0.000	0.980	0.980
CHELPG
AIM
ESP

<r²>	38.823
(<r²>)^1/2	6.231

All results from a given calculation for BHF2 (Difluoroborane)

using model chemistry: BLYP/6-31+G**

States and conformations

All results from a given calculation for BHF₂ (Difluoroborane)