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III.G.1.a.

Compare Calculated Bonds for N-O

ROHF/6-31G

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


Values greater than 1.50 are in the 1.50 bin. Values less than 1.10 are in the 1.10 bin.

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1.10 1.15 1.20 1.25 1.30 1.35 1.40 1.45 1.50
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.215 0.083

  Species Name Bond Length (Å)
Lowest value NO2- Nitrogen dioxide anion 1.113
Highest value BrONO Bromine nitrite 1.430

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
NO- nitric oxide anion 1.144 1 2
NO Nitric oxide 1.144 1 2
NO+ nitric oxide cation 1.144 1 2
NO3- nitrate anion 1.212 1 2
NO3 Nitrogen trioxide 1.212 1 2
NO3+ nitrogen trioxide cation 1.212 1 2
NO2- Nitrogen dioxide anion 1.256 1 3
    1.113 1 3
NO2 Nitrogen dioxide 1.256 1 3
    1.113 1 3
NO2+ Nitrogen dioxide cation 1.256 1 3
    1.113 1 3
BrONO Bromine nitrite 1.162 3 4
NO3- nitrate anion 1.212 1 3
NO3 Nitrogen trioxide 1.212 1 3
NO3+ nitrogen trioxide cation 1.212 1 3
N2O Nitrous oxide 1.353 2 3
N2O+ Nitrous oxide cation 1.353 2 3
HNO2 Nitrous acid 1.257 2 3
HNO2+ nitrous acid cation 1.257 2 3
N2O- Nitrous oxide anion 1.353 2 3
BrONO Bromine nitrite 1.430 2 3
NO3- nitrate anion 1.212 1 4
NO3 Nitrogen trioxide 1.212 1 4
NO3+ nitrogen trioxide cation 1.212 1 4
HNO- Nitrosyl hydride anion 1.337 2 3
    1.115 2 3
HNO Nitrosyl hydride 1.337 2 3
    1.115 2 3
HNO+ Nitrosyl hydride cation 1.337 2 3
    1.115 2 3
NO2- Nitrogen dioxide anion 1.256 1 2
    1.113 1 2
NO2 Nitrogen dioxide 1.256 1 2
    1.113 1 2
NO2+ Nitrogen dioxide cation 1.256 1 2
    1.113 1 2
BrNO Nitrosyl bromide 1.136 1 3
HNO2 Nitrous acid 1.200 3 4
HNO2+ nitrous acid cation 1.200 3 4