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Compare Experimental Geometries - experimental data

Species Name
CHFClBr fluorochlorobromomethane
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
rCH 1.088 1997Bau/Bei:7558   1 5   
rCF 1.356 1997Bau/Bei:7558   1 4   
rCCl 1.745 1997Bau/Bei:7558   1 3   
rCBr 1.928 1997Bau/Bei:7558   1 2   
aHCF 108.8 1997Bau/Bei:7558 fixed 4 1 5  
aHCCl 108.5 1997Bau/Bei:7558 fixed 3 1 5  
aHCBr 108.5 1997Bau/Bei:7558 fixed 2 1 5  
aFCCl 109.9 1997Bau/Bei:7558   3 1 4  
aFCBr 109.0 1997Bau/Bei:7558   2 1 4  
aClCBr 112.1 1997Bau/Bei:7558   2 1 3  

picture of
References
squibreference
1997Bau/Bei:7558 A Bauder, A Beil, D Luckhaus, F Muller, M Quack "Combined high resolution infrared and microwave study of bromochlorofluoromethane" J. Chem. Phys. 106(18) 7558, 1997