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Geometry for CBr3Cl (tribromochloromethane) 1A1 C3V

1910171554
InChI=1S/CBr3Cl/c2-1(3,4)5 INChIKey=GKXZMEXQUWZGJK-UHFFFAOYSA-N

CID/3-21G*


Point group is C3v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.3005   0.0000 0.0000 0.3005
Cl2 0.0000 0.0000 2.0814   0.0000 0.0000 2.0814
Br3 0.0000 1.8261 -0.3542   1.8261 -0.0000 -0.3542
Br4 1.5814 -0.9130 -0.3542   -0.9130 1.5814 -0.3542
Br5 -1.5814 -0.9130 -0.3542   -0.9130 -1.5814 -0.3542
Atom - Atom Distances (Å)
  C1 Cl2 Br3 Br4 Br5
C1 1.7810 1.9399 1.9399 1.9399
Cl2 1.7810 3.0441 3.0441 3.0441
Br3 1.9399 3.0441 3.1629 3.1629
Br4 1.9399 3.0441 3.1629 3.1629
Br5 1.9399 3.0441 3.1629 3.1629
Maximum atom distance is 3.1629Å between atoms Br4 and Br5.
picture of tribromochloromethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl2 C1 Br3 109.722 Cl2 C1 Br4 109.722
Cl2 C1 Br5 109.722 Br3 C1 Br4 109.220
Br3 C1 Br5 109.220 Br4 C1 Br5 109.220

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