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III.G.1.a.

Compare Calculated Bonds for N-O

ROMP2/aug-cc-pVTZ

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


Values greater than 1.34 are in the 1.34 bin. Values less than 1.12 are in the 1.12 bin.

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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
1.210 0.072

  Species Name Bond Length (Å)
Lowest value HNO2 Nitrous acid 1.130
Highest value NO3- nitrate 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 1.265 1 2
NO2 Nitrogen dioxide 1.265 1 2
NO2+ Nitrogen dioxide cation 1.265 1 2
NO2- Nitrogen dioxide anion 1.265 1 3
NO2 Nitrogen dioxide 1.265 1 3
NO2+ Nitrogen dioxide cation 1.265 1 3
NO2- Nitrogen dioxide anion 1.138 1 2
NO2 Nitrogen dioxide 1.138 1 2
NO2+ Nitrogen dioxide cation 1.138 1 2
NO2- Nitrogen dioxide anion 1.138 1 3
NO2 Nitrogen dioxide 1.138 1 3
NO2+ Nitrogen dioxide cation 1.138 1 3
HNO2 Nitrous acid 1.306 2 3
HNO2+ nitrous acid cation 1.306 2 3
HNO2 Nitrous acid 1.130 3 4
HNO2+ nitrous acid cation 1.130 3 4
N2O- Nitrous oxide anion 1.188 2 3
N2O Nitrous oxide 1.188 2 3
N2O+ Nitrous oxide cation 1.188 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
NO3- nitrate anion 1.146 1 2
NO3 Nitrogen trioxide 1.146 1 2
NO3+ nitrogen trioxide cation 1.146 1 2
NO3- nitrate anion 1.319 1 3
NO3 Nitrogen trioxide 1.319 1 3
NO3+ nitrogen trioxide cation 1.319 1 3
NO3- nitrate anion 1.319 1 4
NO3 Nitrogen trioxide 1.319 1 4
NO3+ nitrogen trioxide cation 1.319 1 4
HNO- Nitrosyl hydride anion 1.225 2 3
HNO Nitrosyl hydride 1.225 2 3
HNO+ Nitrosyl hydride cation 1.225 2 3
HNO- Nitrosyl hydride anion 1.135 2 3
HNO Nitrosyl hydride 1.135 2 3
HNO+ Nitrosyl hydride cation 1.135 2 3