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Geometry for CHF2Cl (difluorochloromethane) 1A' CS

1910171554
InChI=1S/CHClF2/c2-1(3)4/h1H INChIKey=VOPWNXZWBYDODV-UHFFFAOYSA-N

HF/6-31G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.5876 -0.0825 0.0000   0.3862 -0.4428 -0.0825
H2 -1.4470 0.5499 0.0000   0.9511 -1.0905 0.5499
Cl3 0.9147 0.9299 0.0000   -0.6012 0.6893 0.9299
F4 -0.5876 -0.8813 1.1037   1.2180 0.2826 -0.8813
F5 -0.5876 -0.8813 -1.1037   -0.4456 -1.1683 -0.8813
Atom - Atom Distances (Å)
  C1 H2 Cl3 F4 F5
C1 1.0670 1.8116 1.3624 1.3624
H2 1.0670 2.3920 2.0012 2.0012
Cl3 1.8116 2.3920 2.5991 2.5991
F4 1.3624 2.0012 2.5991 2.2074
F5 1.3624 2.0012 2.5991 2.2074
Maximum atom distance is 2.5991Å between atoms Cl3 and F4.
picture of difluorochloromethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
F3 C1 F4 109.126 F3 C1 Cl5 109.126
F4 C1 Cl5 108.211
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 F3 109.677 H2 C1 F4 110.334
H2 C1 Cl5 110.334

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