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Geometry for CHCl3 (Chloroform) 1A1 C3V

1910171554
InChI=1S/CHCl3/c2-1(3)4/h1H INChIKey=HEDRZPFGACZZDS-UHFFFAOYSA-N

B1B95/aug-cc-pVTZ


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.4553   0.0000 -0.0000 0.4553
H2 0.0000 0.0000 1.5344   0.0000 -0.0000 1.5344
Cl3 0.0000 1.6770 -0.0837   1.6770 0.0000 -0.0837
Cl4 1.4523 -0.8385 -0.0837   -0.8385 1.4523 -0.0837
Cl5 -1.4523 -0.8385 -0.0837   -0.8385 -1.4523 -0.0837
Atom - Atom Distances (Å)
  C1 H2 Cl3 Cl4 Cl5
C1 1.0791 1.7615 1.7615 1.7615
H2 1.0791 2.3303 2.3303 2.3303
Cl3 1.7615 2.3303 2.9046 2.9046
Cl4 1.7615 2.3303 2.9046 2.9046
Cl5 1.7615 2.3303 2.9046 2.9046
Maximum atom distance is 2.9046Å between atoms Cl3 and Cl4.
picture of Chloroform
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl3 C1 Cl4 111.073 Cl3 C1 Cl5 111.073
Cl4 C1 Cl5 111.073
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 Cl3 107.817 H2 C1 Cl4 107.817
H2 C1 Cl5 107.817

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