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Geometry for CI4 (tetraiodomethane) 1A1 TD

1910171554
InChI=1S/CI4/c2-1(3,4)5 INChIKey=JOHCVVJGGSABQY-UHFFFAOYSA-N

HF/cc-pVTZ-PP


Point group is Td
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.0000 0.0000   0.0000 0.0000 0.0000
I2 1.2481 1.2481 1.2481   1.2481 1.2481 1.2481
I3 -1.2481 -1.2481 1.2481   1.2481 -1.2481 -1.2481
I4 -1.2481 1.2481 -1.2481   -1.2481 1.2481 -1.2481
I5 1.2481 -1.2481 -1.2481   -1.2481 -1.2481 1.2481
Atom - Atom Distances (Å)
  C1 I2 I3 I4 I5
C1 2.1617 2.1617 2.1617 2.1617
I2 2.1617 3.5300 3.5300 3.5300
I3 2.1617 3.5300 3.5300 3.5300
I4 2.1617 3.5300 3.5300 3.5300
I5 2.1617 3.5300 3.5300 3.5300
Maximum atom distance is 3.5300Å between atoms I2 and I3.
picture of tetraiodomethane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
I2 C1 I3 109.471 I2 C1 I4 109.471
I2 C1 I5 109.471 I3 C1 I4 109.471
I3 C1 I5 109.471 I4 C1 I5 109.471

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