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18 10 26 16 45

HF/aug-cc-pVDZ for rNCl

Histogram of Bond length differences (in Å) vs number of species


Differences greater than 0.160 are in the 0.160 bin. Differences less than -0.080 are in the -0.080 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2
histogram chart 0 histogram chart histogram chart histogram chart histogram chart
-0.080 -0.060 -0.040 -0.020 0.000 0.020 0.040 0.060 0.080 0.100 0.120 0.140 0.160
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference ClNO2 Nitryl chloride-0.069
Most positive difference NCl nitrogen monochloride0.056

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
ClNO2 Nitryl chloride 1.840 -0.069
ClNO Nitrosyl chloride 1.975 -0.036
NHCl2 dichloroamine 1.760 -0.027
NCl3 nitrogen trichloride 1.754 -0.020
NCl nitrogen monochloride 1.611 0.056