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Geometry for CHFCl2 (fluorodichloromethane) 1A' CS

1910171554
InChI=1S/CHCl2F/c2-1(3)4/h1H INChIKey=UMNKXPULIDJLSU-UHFFFAOYSA-N

MP2=FULL/6-31G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.1905 0.5464 0.0000   -0.2677 0.4763 -0.1905
H2 -1.0770 1.1727 0.0000   -0.5745 1.0223 -1.0770
F3 0.9664 1.3529 0.0000   -0.6629 1.1794 0.9664
Cl4 -0.1905 -0.4890 1.5333   1.5763 0.3249 -0.1905
Cl5 -0.1905 -0.4890 -1.5333   -1.0971 -1.1776 -0.1905
Atom - Atom Distances (Å)
  C1 H2 F3 Cl4 Cl5
C1 1.0854 1.4103 1.8502 1.8502
H2 1.0854 2.0513 2.4286 2.4286
F3 1.4103 2.0513 2.6613 2.6613
Cl4 1.8502 2.4286 2.6613 3.0667
Cl5 1.8502 2.4286 2.6613 3.0667
Maximum atom distance is 3.0667Å between atoms Cl4 and Cl5.
picture of fluorodichloromethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F3 C1 Cl4 108.667 F3 C1 Cl5 108.667
Cl4 C1 Cl5 111.937
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 F3 109.878 H2 C1 Cl4 108.839
H2 C1 Cl5 108.839

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