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III.G.1.a.

Compare Calculated Bonds for N-O

B1B95/cc-pVQZ

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


Values greater than 1.34 are in the 1.34 bin. Values less than 1.10 are in the 1.10 bin.

histogram chart 18 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 line line line line line line
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histogram chart 4 line histogram chart line line histogram chart line line line line line line line line line line line histogram chart line line line line line histogram chart line line line line line line line line line line line line line line line line
histogram chart 2 line histogram chart line line histogram chart line line histogram chart line line line line line histogram chart line line histogram chart line line line line line histogram chart line line histogram chart line line line line line line line line histogram chart line line line line
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1.10 1.12 1.14 1.16 1.18 1.20 1.22 1.24 1.26 1.28 1.30 1.32 1.34
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.198 0.059

  Species Name Bond Length (Å)
Lowest value NO2- Nitrogen dioxide anion 1.110
Highest value HNO- Nitrosyl hydride anion 1.319

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
NO2- Nitrogen dioxide anion 1.249 1 3
    1.110 1 3
NO2 Nitrogen dioxide 1.249 1 3
    1.110 1 3
NO2+ Nitrogen dioxide cation 1.249 1 3
    1.110 1 3
NO- nitric oxide anion 1.250 1 2
    1.138 1 2
NO Nitric oxide 1.250 1 2
    1.138 1 2
NO+ nitric oxide cation 1.250 1 2
    1.138 1 2
NO3- nitrate anion 1.207 1 2
    1.210 1 2
NO3 Nitrogen trioxide 1.207 1 2
    1.210 1 2
NO3+ nitrogen trioxide cation 1.207 1 2
    1.210 1 2
NO2- Nitrogen dioxide anion 1.249 1 2
    1.110 1 2
NO2 Nitrogen dioxide 1.249 1 2
    1.110 1 2
NO2+ Nitrogen dioxide cation 1.249 1 2
    1.110 1 2
NO3- nitrate anion 1.207 1 4
    1.210 1 4
NO3 Nitrogen trioxide 1.207 1 4
    1.210 1 4
NO3+ nitrogen trioxide cation 1.207 1 4
    1.210 1 4
HNO- Nitrosyl hydride anion 1.319 2 3
    1.113 2 3
HNO Nitrosyl hydride 1.319 2 3
    1.113 2 3
HNO+ Nitrosyl hydride cation 1.319 2 3
    1.113 2 3
HNO2 Nitrous acid 1.129 3 4
HNO2+ nitrous acid cation 1.129 3 4
NO3- nitrate anion 1.207 1 3
    1.210 1 3
NO3 Nitrogen trioxide 1.207 1 3
    1.210 1 3
NO3+ nitrogen trioxide cation 1.207 1 3
    1.210 1 3
N2O Nitrous oxide 1.178 2 3
N2O+ Nitrous oxide cation 1.178 2 3
HNO2 Nitrous acid 1.278 2 3
HNO2+ nitrous acid cation 1.278 2 3
N2O- Nitrous oxide anion 1.178 2 3