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18 10 26 16 45

ROMP2/6-311+G(3df,2p) for rCH

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


Differences greater than 0.090 are in the 0.090 bin. Differences less than -0.030 are in the -0.030 bin.

histogram chart 10
histogram chart 8
histogram chart 6 histogram chart
histogram chart 4 histogram chart
histogram chart 2 histogram chart histogram chart
histogram chart 0 histogram chart histogram chart histogram chart histogram chart histogram chart
-0.030 -0.020 -0.010 0.000 0.010 0.020 0.030 0.040 0.050 0.060 0.070 0.080 0.090
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference C2H2O2 Ethanedial-0.030
Most positive difference HCO Formyl radical0.036

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
C2H2O2 Ethanedial 1.132 -0.030
CH2Cl chloromethyl radical 1.090 -0.016
CH2CHF Ethene, fluoro- 1.087 -0.009
CH Methylidyne 1.120 -0.007
C2H4F2 1,2-difluoroethane 1.094 -0.006
C2H3 vinyl 1.080 -0.003
CH3NO2 Methane, nitro- 1.088 -0.002
CH2CHF Ethene, fluoro- 1.082 -0.001
CH3Br methyl bromide 1.082 0.001
C2H2+ acetylene cation 1.077 0.001
CH2CHF Ethene, fluoro- 1.077 0.002
C2H3 vinyl 1.085 0.002
HCO Formyl radical 1.080 0.036