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Geometry for CHFCl2 (fluorodichloromethane) 1A' CS

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

B1B95/6-31G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.1854 0.5422 0.0000   -0.2631 0.4741 -0.1854
H2 -1.0796 1.1530 0.0000   -0.5596 1.0081 -1.0796
F3 0.9438 1.3387 0.0000   -0.6497 1.1705 0.9438
Cl4 -0.1854 -0.4840 1.5124   1.5572 0.3109 -0.1854
Cl5 -0.1854 -0.4840 -1.5124   -1.0875 -1.1571 -0.1854
Atom - Atom Distances (Å)
  C1 H2 F3 Cl4 Cl5
C1 1.0830 1.3818 1.8277 1.8277
H2 1.0830 2.0319 2.4014 2.4014
F3 1.3818 2.0319 2.6238 2.6238
Cl4 1.8277 2.4014 2.6238 3.0248
Cl5 1.8277 2.4014 2.6238 3.0248
Maximum atom distance is 3.0248Å 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 108.882 F3 C1 Cl5 108.882
Cl4 C1 Cl5 111.686
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 F3 110.470 H2 C1 Cl4 108.462
H2 C1 Cl5 108.462

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