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III.G.1.a.

Compare Calculated Bonds for N-O

PBEPBE/Sadlej_pVTZ

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


Values greater than 1.22 are in the 1.22 bin. Values less than 1.16 are in the 1.16 bin.

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1.16 1.16 1.17 1.17 1.18 1.18 1.19 1.19 1.20 1.20 1.21 1.21 1.22
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.196 0.022

  Species Name Bond Length (Å)
Lowest value NO- nitric oxide anion 1.160
Highest value NO2- Nitrogen dioxide anion 1.213

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
N2O+ Nitrous oxide cation 1.199 2 3
N2O Nitrous oxide 1.199 2 3
N2O- Nitrous oxide anion 1.199 2 3
NO- nitric oxide anion 1.160 1 2
NO Nitric oxide 1.160 1 2
NO+ nitric oxide cation 1.160 1 2
NO2- Nitrogen dioxide anion 1.213 1 2
NO2 Nitrogen dioxide 1.213 1 2
NO2+ Nitrogen dioxide cation 1.213 1 2
    1.213 1 3
NO2 Nitrogen dioxide 1.213 1 3
NO2- Nitrogen dioxide anion 1.213 1 3