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Geometry for CaCl2 (Calcium Chloride) 1Σg D*H

1910171554
InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2 INChIKey=UXVMQQNJUSDDNG-UHFFFAOYSA-L

PBE1PBE/TZVP


Point group is D∞h
Atom Internal
x (Å) y (Å) z (Å)
Ca1 0.0000 0.0000 0.0000
Cl2 0.0000 0.0000 2.5918
Cl3 0.0000 0.0000 -2.5918
Atom - Atom Distances (Å)
  Ca1 Cl2 Cl3
Ca1 2.5918 2.5918
Cl2 2.5918 5.1836
Cl3 2.5918 5.1836
Maximum atom distance is 5.1836Å between atoms Cl2 and Cl3.
picture of Calcium Chloride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl2 Ca1 Cl3 180.000

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