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III.G.1.a.

Compare Calculated Bonds for N-O

CISD/3-21G

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


Values greater than 2.80 are in the 2.80 bin. Values less than 1.00 are in the 1.00 bin.

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1.00 1.20 1.40 1.60 1.80 2.00 2.20 2.40 2.60 2.80
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.343 0.278

  Species Name Bond Length (Å)
Lowest value HNO2 Nitrous acid 1.081
Highest value NO3- nitrate anion 2.581

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CH3NHCH2COOH Sarcosine 1.089 2 10
HCNO fulminic acid 1.273 1 2
C3H7ONO Propyl nitrite 1.475 4 5
    1.209 5 6
    1.432 4 5
    1.212 5 6
CH3ONO Methyl nitrite 1.454 2 6
    1.224 6 7
C2H5NO3 Nitric acid, ethyl ester 1.444 1 2
    1.241 1 3
    1.255 1 4
H2NO3+ Nitric Acid, Protonated 1.206 1 2
    1.384 1 3
    1.384 1 4
HNO2 Nitrous acid 2.185 2 3
HNO2+ nitrous acid cation 2.185 2 3
HNO2 Nitrous acid 1.081 3 4
HNO2+ nitrous acid cation 1.081 3 4
NH2OH hydroxylamine 1.515 1 2
N2O- Nitrous oxide anion 1.405 2 3
N2O Nitrous oxide 1.405 2 3
N2O+ Nitrous oxide cation 1.405 2 3
NO- nitric oxide anion 1.347 1 2
NO Nitric oxide 1.347 1 2
NO+ nitric oxide cation 1.347 1 2
NO- nitric oxide anion 1.348 1 2
NO Nitric oxide 1.348 1 2
NO+ nitric oxide cation 1.348 1 2
NO- nitric oxide anion 1.083 1 2
NO Nitric oxide 1.083 1 2
NO+ nitric oxide cation 1.083 1 2
NO2- Nitrogen dioxide anion 1.327 1 2
NO2 Nitrogen dioxide 1.327 1 2
NO2+ Nitrogen dioxide cation 1.327 1 2
NO2- Nitrogen dioxide anion 1.327 1 3
NO2 Nitrogen dioxide 1.327 1 3
NO2+ Nitrogen dioxide cation 1.327 1 3
NO2- Nitrogen dioxide anion 1.147 1 2
NO2 Nitrogen dioxide 1.147 1 2
NO2+ Nitrogen dioxide cation 1.147 1 2
NO2- Nitrogen dioxide anion 1.147 1 3
NO2 Nitrogen dioxide 1.147 1 3
NO2+ Nitrogen dioxide cation 1.147 1 3
N2O3 Dinitrogen trioxide 1.178 1 3
    1.245 2 4
    1.241 2 5
NO3- nitrate anion 1.489 1 2
NO3 Nitrogen trioxide 1.489 1 2
NO3+ nitrogen trioxide cation 1.489 1 2
NO3- nitrate anion 1.243 1 3
NO3 Nitrogen trioxide 1.243 1 3
NO3+ nitrogen trioxide cation 1.243 1 3
NO3- nitrate anion 1.243 1 4
NO3 Nitrogen trioxide 1.243 1 4
NO3+ nitrogen trioxide cation 1.243 1 4
NO3- nitrate anion 2.581 1 2
NO3 Nitrogen trioxide 2.581 1 2
NO3+ nitrogen trioxide cation 2.581 1 2
NO3- nitrate anion 1.143 1 3
NO3 Nitrogen trioxide 1.143 1 3
NO3+ nitrogen trioxide cation 1.143 1 3
NO3- nitrate anion 1.143 1 4
NO3 Nitrogen trioxide 1.143 1 4
NO3+ nitrogen trioxide cation 1.143 1 4
NO3- nitrate anion 1.151 1 2
NO3 Nitrogen trioxide 1.151 1 2
NO3+ nitrogen trioxide cation 1.151 1 2
NO3- nitrate anion 1.447 1 3
NO3 Nitrogen trioxide 1.447 1 3
NO3+ nitrogen trioxide cation 1.447 1 3
NO3- nitrate anion 1.447 1 4
NO3 Nitrogen trioxide 1.447 1 4
NO3+ nitrogen trioxide cation 1.447 1 4
NO3- nitrate anion 1.271 1 2
NO3 Nitrogen trioxide 1.271 1 2
NO3+ nitrogen trioxide cation 1.271 1 2
NO3- nitrate anion 1.271 1 3
NO3 Nitrogen trioxide 1.271 1 3
NO3+ nitrogen trioxide cation 1.271 1 3
NO3- nitrate anion 1.271 1 4
NO3 Nitrogen trioxide 1.271 1 4
NO3+ nitrogen trioxide cation 1.271 1 4
BrNO Nitrosyl bromide 1.186 1 3
HNO- Nitrosyl hydride anion 1.408 2 3
HNO Nitrosyl hydride 1.408 2 3
HNO+ Nitrosyl hydride cation 1.408 2 3
HNO- Nitrosyl hydride anion 1.137 2 3
HNO Nitrosyl hydride 1.137 2 3
HNO+ Nitrosyl hydride cation 1.137 2 3
ClONO2 Chlorine nitrate 1.525 2 3
    1.232 3 4
    1.236 3 5
HOONO2 peroxy nitric acid 1.525 1 2
    1.233 1 4
    1.238 1 5
NH3O Ammonia Oxide 1.528 1 2
CNO- fulminate 1.364 1 3
BrONO Bromine nitrite 1.544 2 3
    1.198 3 4
ONONO Nitrosyl nitrite 1.527 1 2
    1.527 1 3
    1.196 2 4
    1.196 3 5