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III.G.1.a.

Compare Calculated Bonds for N-O

PBEPBE/3-21G*

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


Values greater than 1.70 are in the 1.70 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 1.60 1.65 1.70
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.314 0.116

  Species Name Bond Length (Å)
Lowest value NO- nitric oxide anion 1.102
Highest value ClONO2 Chlorine nitrate 1.622

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
C3H7ONO Propyl nitrite 1.561 4 5
    1.466 4 5
CH3NHCH2COOH Sarcosine 1.102 2 10
H2NO3+ Nitric Acid, Protonated 1.411 1 4
NO- nitric oxide anion 1.362 1 2
NO Nitric oxide 1.362 1 2
NO+ nitric oxide cation 1.362 1 2
NO- nitric oxide anion 1.364 1 2
NO Nitric oxide 1.364 1 2
NO+ nitric oxide cation 1.364 1 2
NO- nitric oxide anion 1.102 1 2
NO Nitric oxide 1.102 1 2
NO+ nitric oxide cation 1.102 1 2
NO2- Nitrogen dioxide anion 1.360 1 3
NO2 Nitrogen dioxide 1.360 1 3
NO2+ Nitrogen dioxide cation 1.360 1 3
NO2- Nitrogen dioxide anion 1.170 1 3
NO2 Nitrogen dioxide 1.170 1 3
NO2+ Nitrogen dioxide cation 1.170 1 3
N2O3 Dinitrogen trioxide 1.271 2 4
NO3- nitrate anion 1.313 1 2
NO3 Nitrogen trioxide 1.313 1 2
NO3+ nitrogen trioxide cation 1.313 1 2
NO3- nitrate anion 1.312 1 2
NO3 Nitrogen trioxide 1.312 1 2
NO3+ nitrogen trioxide cation 1.312 1 2
NO3- nitrate anion 1.177 1 2
NO3 Nitrogen trioxide 1.177 1 2
NO3+ nitrogen trioxide cation 1.177 1 2
NO3- nitrate anion 1.312 1 2
NO3 Nitrogen trioxide 1.312 1 2
NO3+ nitrogen trioxide cation 1.312 1 2
ClONO2 Chlorine nitrate 1.622 2 3
    1.255 3 5
BrONO Bromine nitrite 1.217 3 4
ONONO Nitrosyl nitrite 1.218 3 5
C3H7ONO Propyl nitrite 1.231 5 6
    1.230 5 6
HCNO fulminic acid 1.251 1 2
HOONO2 peroxy nitric acid 1.574 1 2
    1.292 1 5
ClONO2 Chlorine nitrate 1.251 3 4
BrONO Bromine nitrite 1.622 2 3
HNO2 Nitrous acid 1.189 3 4
HNO2+ nitrous acid cation 1.189 3 4
BrNO Nitrosyl bromide 1.206 1 3
NO2- Nitrogen dioxide anion 1.360 1 2
NO2 Nitrogen dioxide 1.360 1 2
NO2+ Nitrogen dioxide cation 1.360 1 2
NO2- Nitrogen dioxide anion 1.170 1 2
NO2 Nitrogen dioxide 1.170 1 2
NO2+ Nitrogen dioxide cation 1.170 1 2
N2O3 Dinitrogen trioxide 1.202 1 3
    1.265 2 5
H2NO3+ Nitric Acid, Protonated 1.229 1 2
NO3- nitrate anion 1.313 1 4
NO3 Nitrogen trioxide 1.313 1 4
NO3+ nitrogen trioxide cation 1.313 1 4
NO3- nitrate anion 1.312 1 4
NO3 Nitrogen trioxide 1.312 1 4
NO3+ nitrogen trioxide cation 1.312 1 4
NO3- nitrate anion 1.462 1 4
NO3 Nitrogen trioxide 1.462 1 4
NO3+ nitrogen trioxide cation 1.462 1 4
NO3- nitrate anion 1.312 1 4
NO3 Nitrogen trioxide 1.312 1 4
NO3+ nitrogen trioxide cation 1.312 1 4
HNO- Nitrosyl hydride anion 1.398 2 3
HNO Nitrosyl hydride 1.398 2 3
HNO+ Nitrosyl hydride cation 1.398 2 3
HNO- Nitrosyl hydride anion 1.177 2 3
HNO Nitrosyl hydride 1.177 2 3
HNO+ Nitrosyl hydride cation 1.177 2 3
CNO- fulminate 1.321 1 3
ONONO Nitrosyl nitrite 1.609 1 2
    1.218 2 4
HNO2 Nitrous acid 1.423 2 3
HNO2+ nitrous acid cation 1.423 2 3
N2O- Nitrous oxide anion 1.262 2 3
N2O Nitrous oxide 1.262 2 3
N2O+ Nitrous oxide cation 1.262 2 3
HOONO2 peroxy nitric acid 1.250 1 4
H2NO3+ Nitric Acid, Protonated 1.411 1 3
NO3- nitrate anion 1.313 1 3
NO3 Nitrogen trioxide 1.313 1 3
NO3+ nitrogen trioxide cation 1.313 1 3
NO3- nitrate anion 1.312 1 3
NO3 Nitrogen trioxide 1.312 1 3
NO3+ nitrogen trioxide cation 1.312 1 3
NO3- nitrate anion 1.462 1 3
NO3 Nitrogen trioxide 1.462 1 3
NO3+ nitrogen trioxide cation 1.462 1 3
NO3- nitrate anion 1.312 1 3
NO3 Nitrogen trioxide 1.312 1 3
NO3+ nitrogen trioxide cation 1.312 1 3
NH3O Ammonia Oxide 1.398 1 2
ONONO Nitrosyl nitrite 1.609 1 3