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Geometry for BClF2 (Chlorodifluoroborane) 1A1 C2V

1910171554
InChI=1S/BClF2/c2-1(3)4 INChIKey=ARGRMFKYCQHOAU-UHFFFAOYSA-N

MP2/CEP-121G


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
B1 0.0000 0.0000 -0.4477   -0.4477 0.0000 0.0000
Cl2 0.0000 0.0000 1.3486   1.3486 0.0000 0.0000
F3 0.0000 1.1723 -1.1493   -1.1493 1.1723 0.0000
F4 0.0000 -1.1723 -1.1493   -1.1493 -1.1723 0.0000
Atom - Atom Distances (Å)
  B1 Cl2 F3 F4
B1 1.7962 1.3662 1.3662
Cl2 1.7962 2.7592 2.7592
F3 1.3662 2.7592 2.3446
F4 1.3662 2.7592 2.3446
Maximum atom distance is 2.7592Å between atoms Cl2 and F3.
picture of Chlorodifluoroborane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl2 B1 F3 120.900 Cl2 B1 F4 120.900
F3 B1 F4 118.200

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.