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Geometry for CHBr3 (bromoform) 1A1 C3V

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

CCD/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 0.5410   0.0000 -0.0000 0.5410
H2 0.0000 0.0000 1.6217   0.0000 -0.0000 1.6217
Br3 0.0000 1.8505 -0.0464   0.0000 1.8505 -0.0464
Br4 1.6026 -0.9252 -0.0464   1.6026 -0.9252 -0.0464
Br5 -1.6026 -0.9252 -0.0464   -1.6026 -0.9252 -0.0464
Atom - Atom Distances (Å)
  C1 H2 Br3 Br4 Br5
C1 1.0806 1.9415 1.9415 1.9415
H2 1.0806 2.4913 2.4913 2.4913
Br3 1.9415 2.4913 3.2051 3.2051
Br4 1.9415 2.4913 3.2051 3.2051
Br5 1.9415 2.4913 3.2051 3.2051
Maximum atom distance is 3.2051Å 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 111.266 Br3 C1 Br5 111.266
Br4 C1 Br5 111.266
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
H2 C1 Br3 107.611 H2 C1 Br4 107.611
H2 C1 Br5 107.611

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