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Geometry for CH2BrF (Methane, bromofluoro-) 1A' CS

1910171554
InChI=1S/CH2BrF/c2-1-3/h1H2 INChIKey=LHMHCLYDBQOYTO-UHFFFAOYSA-N

LSDA/cc-pVDZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.5044 -1.1173 0.0000   -1.1603 0.3955 0.0000
F2 -0.5811 -1.9093 0.0000   -1.8452 -0.7606 0.0000
Br3 0.0000 0.7553 0.0000   0.7519 0.0720 0.0000
H4 1.1021 -1.2744 0.9209   -1.3737 0.9755 0.9209
H5 1.1021 -1.2744 -0.9209   -1.3737 0.9755 -0.9209
Atom - Atom Distances (Å)
  C1 F2 Br3 H4 H5
C1 1.3437 1.9393 1.1091 1.1091
F2 1.3437 2.7273 2.0210 2.0210
Br3 1.9393 2.7273 2.4865 2.4865
H4 1.1091 2.0210 2.4865 1.8418
H5 1.1091 2.0210 2.4865 1.8418
Maximum atom distance is 2.7273Å between atoms F2 and Br3.
picture of Methane, bromofluoro-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 C1 Br3 111.043
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F2 C1 H4 110.601 F2 C1 H5 110.601
Br3 C1 H4 106.081 Br3 C1 H5 106.081
H4 C1 H5 112.265

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