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Geometry for CHBr3 (bromoform) 1A1 C3V

1910171554
InChI=1S/CHBr3/c2-1(3)4/h1H INChIKey=DIKBFYAXUHHXCS-UHFFFAOYSA-N

MP3/6-31G*


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.5448   0.0000 -0.0000 0.5448
H2 0.0000 0.0000 1.6268   0.0000 -0.0000 1.6268
Br3 0.0000 1.8501 -0.0466   1.8501 0.0000 -0.0466
Br4 1.6022 -0.9250 -0.0466   -0.9250 1.6022 -0.0466
Br5 -1.6022 -0.9250 -0.0466   -0.9250 -1.6022 -0.0466
Atom - Atom Distances (Å)
  C1 H2 Br3 Br4 Br5
C1 1.0820 1.9423 1.9423 1.9423
H2 1.0820 2.4947 2.4947 2.4947
Br3 1.9423 2.4947 3.2045 3.2045
Br4 1.9423 2.4947 3.2045 3.2045
Br5 1.9423 2.4947 3.2045 3.2045
Maximum atom distance is 3.2045Å between atoms Br3 and Br4.
picture of bromoform
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br3 C1 Br4 111.157 Br3 C1 Br5 111.157
Br4 C1 Br5 111.157
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 Br3 107.727 H2 C1 Br4 107.727
H2 C1 Br5 107.727

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