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Compare Experimental Geometries - experimental data

Species Name
CH2ClI chloroiodomethane
The following table lists the experimentally determined internal coordinates. Coordinate descriptions starting with "r" are bond lengths, starting with "a" are bond angles, and starting with "d" are dihedral angles. Atom numbers are the numbers on the picture of the molecule below to indicate which atoms are invloved in the bond or angle.
Units: bond lengths are in Å, angles are in degrees.
description Value Reference Comment Atom number
rCI 2.137 1987Ohk/Nii:118-129   1 3   
rCCl 1.774 1987Ohk/Nii:118-129   1 2   
rHC 1.062 1987Ohk/Nii:118-129   1 4   
aClCI 112.8 1987Ohk/Nii:118-129   2 1 3  
aHCCl 108.7 1987Ohk/Nii:118-129   2 1 4  
aHCH 111.0 1987Ohk/Nii:118-129   4 1 5  

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