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Geometry for CHBrCl2 (Methane, bromodichloro-) 1A' CS

1910171554
InChI=1S/CHBrCl2/c2-1(3)4/h1H INChIKey=FMWLUWPQPKEARP-UHFFFAOYSA-N

B1B95/3-21G


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 -0.6796 -0.1154 0.0000   0.3864 -0.5591 -0.1154
H2 -1.5825 0.4829 0.0000   0.8998 -1.3017 0.4829
Br3 0.8219 1.0957 0.0000   -0.4673 0.6761 1.0957
Cl4 -0.6796 -1.1218 1.4676   1.5937 0.2754 -1.1218
Cl5 -0.6796 -1.1218 -1.4676   -0.8208 -1.3935 -1.1218
Atom - Atom Distances (Å)
  C1 H2 Br3 Cl4 Cl5
C1 1.0831 1.9291 1.7795 1.7795
H2 1.0831 2.4812 2.3546 2.3546
Br3 1.9291 2.4812 3.0538 3.0538
Cl4 1.7795 2.3546 3.0538 2.9351
Cl5 1.7795 2.3546 3.0538 2.9351
Maximum atom distance is 3.0538Å between atoms Br3 and Cl4.
picture of Methane, bromodichloro-
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br3 C1 Cl4 110.797 Br3 C1 Cl5 110.797
Cl4 C1 Cl5 111.121
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 Br3 107.575 H2 C1 Cl4 108.206
H2 C1 Cl5 108.206

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