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III.G.1.a.

Compare Calculated Bonds for N-O

BLYP/TZVP

Histogram of Bond lengths (in Å) vs number of species


Values greater than 1.70 are in the 1.70 bin. Values less than 1.20 are in the 1.20 bin.

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histogram chart 2 line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line
histogram chart 1 line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line
histogram chart 0 line histogram chart line line line line line line line line line line line line line line line line line line line line line line line line line line histogram chart line line line line
1.20 1.25 1.30 1.35 1.40 1.45 1.50 1.55 1.60 1.65 1.70
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.416 0.216

  Species Name Bond Length (Å)
Lowest value ClONO2 Chlorine nitrate 1.200
Highest value ClONO2 Chlorine nitrate 1.633

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
ClONO2 Chlorine nitrate 1.633 2 3
    1.200 3 4