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Compare Calculated Bonds for O-N

17 01 10 14 40

MP3/Def2TZVPP

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


Values greater than 1.55 are in the 1.55 bin. Values less than 1.00 are in the 1.00 bin.

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histogram chart 4 line line line line line line line line line line line line line histogram chart line line line line line line line line line line line line line line line line line line line line line line
histogram chart 3 line line line line line line line line line line line line line histogram chart line line line line line line line line line line line line line line line line line line line line line line
histogram chart 2 line line line line line line line line line line line line line histogram chart line line line line line line line line histogram chart line line line line line line line line line line line line line
histogram chart 1 line line line line line 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 line histogram chart line line line line line line line
histogram chart 0 line line line line histogram chart line line histogram chart line line histogram chart line line histogram chart line line histogram chart line line histogram chart line line histogram chart line line histogram chart line line histogram chart line line line line line line line
1.00 1.05 1.10 1.15 1.20 1.25 1.30 1.35 1.40 1.45 1.50 1.55
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.238 0.114

  Species Name Bond Length (Å)
Lowest value NO+ nitric oxide cation 1.049
Highest value NH2OH2+ protonated hydroxylamine 1.462

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
NO- nitric oxide anion 1.252 1 2
NO Nitric oxide 1.130 1 2
NO+ nitric oxide cation 1.049 1 2
HNO+ Nitrosyl hydride cation 1.094 2 3
NH2OH hydroxylamine 1.428 1 2
NH2OH+ Hydroxylamine cation 1.279 1 2
NH3OH+ N-protonated hydroxylamine 1.393 1 2
NH2OH2+ protonated hydroxylamine 1.462 1 2
N2O Nitrous oxide 1.177 2 3
SNO Nitrogen oxide sulfide 1.178 1 3
INO Nitrosyl iodide 1.126 1 2
CH3NO2 Methane, nitro- 1.206 2 6
    1.206 2 7
C2H2N2O Furazan 1.352 1 2
    1.352 1 3
C3H3NO Isoxazole 1.374 4 5
N2O4 Dinitrogen tetroxide 1.175 1 3
    1.175 1 4
    1.175 2 5
    1.175 2 6