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III.G.1.a.

Compare Calculated Bonds for N-O

B3LYP/cc-pCVTZ

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


Values greater than 1.21 are in the 1.21 bin. Values less than 1.12 are in the 1.12 bin.

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1.12 1.13 1.14 1.15 1.16 1.17 1.18 1.19 1.20 1.21
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.182 0.023

  Species Name Bond Length (Å)
Lowest value FNO Nitrosyl fluoride 1.129
Highest value HNO- Nitrosyl hydride anion 1.198

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
FNO Nitrosyl fluoride 1.129 2 3
N2O- Nitrous oxide anion 1.183 2 3
N2O Nitrous oxide 1.183 2 3
N2O+ Nitrous oxide cation 1.183 2 3
HNO- Nitrosyl hydride anion 1.198 2 3
HNO Nitrosyl hydride 1.198 2 3
HNO+ Nitrosyl hydride cation 1.198 2 3