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III.G.1.a.

Compare Calculated Bonds for N-O

CCSD(T)/cc-pVQZ

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


Values greater than 1.36 are in the 1.36 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 1.36
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.252 0.085

  Species Name Bond Length (Å)
Lowest value BrNO Nitrosyl bromide 1.139
Highest value NH3O Ammonia Oxide 1.368

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
BrNO Nitrosyl bromide 1.139 1 3
NH3O Ammonia Oxide 1.368 1 2
NO- nitric oxide anion 1.269 1 2
NO Nitric oxide 1.269 1 2
NO+ nitric oxide cation 1.269 1 2
NO- nitric oxide anion 1.150 1 2
NO Nitric oxide 1.150 1 2
NO+ nitric oxide cation 1.150 1 2
HNO- Nitrosyl hydride anion 1.336 2 3
HNO Nitrosyl hydride 1.336 2 3
HNO+ Nitrosyl hydride cation 1.336 2 3