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Geometry for CHBr2F (dibromofluoromethane) 1A' CS

1910171554
InChI=1S/CHBr2F/c2-1(3)4/h1H INChIKey=LTUTVFXOEGMHMP-UHFFFAOYSA-N

QCISD/3-21G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.1065 0.8133 0.0000   -0.3563 0.7311 -0.1065
H2 -1.0233 1.4002 0.0000   -0.6135 1.2586 -1.0233
F3 1.0126 1.6445 0.0000   -0.7205 1.4782 1.0126
Br4 -0.1065 -0.3011 1.6027   1.5726 0.4316 -0.1065
Br5 -0.1065 -0.3011 -1.6027   -1.3087 -0.9729 -0.1065
Atom - Atom Distances (Å)
  C1 H2 F3 Br4 Br5
C1 1.0886 1.3940 1.9521 1.9521
H2 1.0886 2.0505 2.5107 2.5107
F3 1.3940 2.0505 2.7580 2.7580
Br4 1.9521 2.5107 2.7580 3.2054
Br5 1.9521 2.5107 2.7580 3.2054
Maximum atom distance is 3.2054Å between atoms Br4 and Br5.
picture of dibromofluoromethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F3 C1 Br4 109.901 F3 C1 Br5 109.901
Br4 C1 Br5 110.376
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 F3 110.774 H2 C1 Br4 107.925
H2 C1 Br5 107.925

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