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III.G.1.a.

Compare Calculated Bonds for N-O

CCSD(T)/aug-cc-pVTZ

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


Values greater than 1.55 are in the 1.55 bin. Values less than 1.05 are in the 1.05 bin.

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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 0.106

  Species Name Bond Length (Å)
Lowest value NO- nitric oxide anion 1.069
Highest value BrONO Bromine nitrite 1.497

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
H2NO3+ Nitric Acid, Protonated 1.316 1 3
HNO2 Nitrous acid 1.140 3 4
HNO2+ nitrous acid cation 1.140 3 4
NH3O Ammonia Oxide 1.380 1 2
ONONO Nitrosyl nitrite 1.486 1 3
H2NO3+ Nitric Acid, Protonated 1.316 1 4
NO3- nitrate anion 1.325 1 4
NO3 Nitrogen trioxide 1.325 1 4
NO3+ nitrogen trioxide cation 1.325 1 4
HNO- Nitrosyl hydride anion 1.340 2 3
    1.129 2 3
HNO Nitrosyl hydride 1.340 2 3
    1.129 2 3
HNO+ Nitrosyl hydride cation 1.340 2 3
    1.129 2 3
BrONO Bromine nitrite 1.497 2 3
ONONO Nitrosyl nitrite 1.165 2 4
HNO2 Nitrous acid 1.309 2 3
HNO2+ nitrous acid cation 1.309 2 3
N2O Nitrous oxide 1.191 2 3
    1.201 2 3
N2O+ Nitrous oxide cation 1.191 2 3
    1.201 2 3
N2O- Nitrous oxide anion 1.191 2 3
    1.201 2 3
NO- nitric oxide anion 1.272 1 2
    1.258 1 2
    1.153 1 2
    1.069 1 2
NO Nitric oxide 1.272 1 2
    1.258 1 2
    1.153 1 2
    1.069 1 2
NO+ nitric oxide cation 1.272 1 2
    1.258 1 2
    1.153 1 2
    1.069 1 2
NO3- nitrate anion 1.141 1 2
NO3 Nitrogen trioxide 1.141 1 2
NO3+ nitrogen trioxide cation 1.141 1 2
BrNO Nitrosyl bromide 1.144 1 3
CNO- fulminate 1.276 1 3
ONONO Nitrosyl nitrite 1.486 1 2
H2NO3+ Nitric Acid, Protonated 1.173 1 2
NO3- nitrate anion 1.325 1 3
NO3 Nitrogen trioxide 1.325 1 3
NO3+ nitrogen trioxide cation 1.325 1 3
BrONO Bromine nitrite 1.161 3 4
ONONO Nitrosyl nitrite 1.165 3 5