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III.G.1.a.

Compare Calculated Bonds for N-O

CCSD(T)=FULL/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 1.10 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 1.55
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.255 0.109

  Species Name Bond Length (Å)
Lowest value NO3- nitrate anion 1.137
Highest value HOONO2 peroxy nitric acid 1.484

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
H2NO3+ Nitric Acid, Protonated 1.169 1 2
    1.310 1 3
    1.310 1 4
FNO Nitrosyl fluoride 1.138 2 3
NO- nitric oxide anion 1.270 1 2
    1.150 1 2
NO Nitric oxide 1.270 1 2
    1.150 1 2
NO+ nitric oxide cation 1.270 1 2
    1.150 1 2
NO3- nitrate anion 1.137 1 2
NO3 Nitrogen trioxide 1.137 1 2
NO3+ nitrogen trioxide cation 1.137 1 2
    1.318 1 3
NO3 Nitrogen trioxide 1.318 1 3
NO3- nitrate anion 1.318 1 3
    1.318 1 4
NO3 Nitrogen trioxide 1.318 1 4
NO3+ nitrogen trioxide cation 1.318 1 4
BrNO Nitrosyl bromide 1.139 1 3
HNO Nitrosyl hydride 1.210 2 3
HNO+ Nitrosyl hydride cation 1.210 2 3
HNO- Nitrosyl hydride anion 1.210 2 3
HOONO2 peroxy nitric acid 1.484 1 2
    1.191 1 4
    1.191 1 5
NH3O Ammonia Oxide 1.363 1 2
BrONO Bromine nitrite 1.482 2 3
    1.159 3 4
ONONO Nitrosyl nitrite 1.473 1 2
    1.473 1 3
    1.162 2 4
    1.162 3 5