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18 10 26 16 45

MP4/cc-pVTZ-PP for rCI

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


Differences greater than 0.022 are in the 0.022 bin. Differences less than -0.002 are in the -0.002 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 histogram chart
-0.002 0.000 0.002 0.004 0.006 0.008 0.010 0.012 0.014 0.016 0.018 0.020 0.022
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference CH2I2 Diiodomethane0.001
Most positive difference CI4 tetraiodomethane0.014

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
CH2I2 Diiodomethane 2.135 0.001
CH3I methyl iodide 2.136 0.003
C2H5I Ethyl iodide 2.151 0.003
CH2ClI chloroiodomethane 2.137 0.005
ICN Cyanogen iodide 1.992 0.008
CH2FI fluoroiodomethane 2.140 0.008
CI4 tetraiodomethane 2.157 0.014