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Geometry for CHBr3 (bromoform) 1A1 C3V

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

B3PW91/6-31G*


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.5367   0.0000 -0.0000 0.5367
H2 0.0000 0.0000 1.6211   0.0000 -0.0000 1.6211
Br3 0.0000 1.8439 -0.0461   0.0000 1.8439 -0.0461
Br4 1.5968 -0.9219 -0.0461   1.5968 -0.9219 -0.0461
Br5 -1.5968 -0.9219 -0.0461   -1.5968 -0.9219 -0.0461
Atom - Atom Distances (Å)
  C1 H2 Br3 Br4 Br5
C1 1.0844 1.9338 1.9338 1.9338
H2 1.0844 2.4858 2.4858 2.4858
Br3 1.9338 2.4858 3.1937 3.1937
Br4 1.9338 2.4858 3.1937 3.1937
Br5 1.9338 2.4858 3.1937 3.1937
Maximum atom distance is 3.1937Å between atoms Br4 and Br5.
picture of bromoform
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Br3 C1 Br4 111.330 Br3 C1 Br5 111.330
Br4 C1 Br5 111.330
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 Br3 107.541 H2 C1 Br4 107.541
H2 C1 Br5 107.541

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