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III.G.1.a.

Compare Calculated Bonds for N-O

MP2/3-21G

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


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

Summary: (Å)
Average bond length Standard deviation
1.333 0.127

  Species Name Bond Length (Å)
Lowest value CH3NHCH2COOH Sarcosine 1.093
Highest value FNO3 Fluorine nitrate 1.685

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CH3NO2 Methane, nitro- 1.304 2 7
C6H5NO2 Nitrobenzene 1.302 7 9
CH3NO3 Methyl nitrate 1.277 1 3
HCNO fulminic acid 1.245 1 2
CH3CH(CH3)ONO Iso-propyl nitrite 1.518 11 13
C3H7ONO Propyl nitrite 1.261 5 6
    1.238 5 6
CH3ONO Methyl nitrite 1.484 2 6
C2H5NO3 Nitric acid, ethyl ester 1.501 1 2
C4H5NO Isoxazole, 5-methyl- 1.494 6 7
ClONO2 Chlorine nitrate 1.250 3 4
HNO3 Nitric acid 1.279 1 3
N2O5 Dinitrogen pentoxide 1.262 3 7
N2O4 Dinitrogen tetroxide 1.267 1 3
    1.267 2 5
ClNO2 Nitryl chloride 1.249 2 3
HOONO2 peroxy nitric acid 1.637 1 2
    1.256 1 5
C2H6N2O2 (E)-Azodioxymethane 1.313 1 3
BrONO Bromine nitrite 1.625 2 3
CH3CHNOH Acetaldoxime 1.508 3 4
CH3ONO Methyl nitrite 1.274 6 7
H2NO3+ Nitric Acid, Protonated 1.381 1 3
FNO3 Fluorine nitrate 1.249 1 3
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 1.477 1 3
NO3 Nitrogen trioxide 1.477 1 3
NO3+ nitrogen trioxide cation 1.477 1 3
NO3- nitrate anion 1.398 1 3
NO3 Nitrogen trioxide 1.398 1 3
NO3+ nitrogen trioxide cation 1.398 1 3
HNO2 Nitrous acid 1.518 2 3
HNO2+ nitrous acid cation 1.518 2 3
HNO2 Nitrous acid 1.377 2 3
HNO2+ nitrous acid cation 1.377 2 3
N2O- Nitrous oxide anion 1.224 2 3
N2O Nitrous oxide 1.224 2 3
N2O+ Nitrous oxide cation 1.224 2 3
N2O- Nitrous oxide anion 1.409 2 3
N2O Nitrous oxide 1.409 2 3
N2O+ Nitrous oxide cation 1.409 2 3
N2O5 Dinitrogen pentoxide 1.262 2 6
    1.264 3 5
N2O4 Dinitrogen tetroxide 1.267 1 4
CH3NO3 Methyl nitrate 1.279 1 2
HOONO2 peroxy nitric acid 1.262 1 4
C2H6N2O2 (E)-Azodioxymethane 1.313 2 4
NH3O Ammonia Oxide 1.508 1 2
ONONO Nitrosyl nitrite 1.599 1 3
CH3NHCH2COOH Sarcosine 1.093 2 10
C3H7ONO Propyl nitrite 1.520 4 5
    1.457 4 5
C2H5NO3 Nitric acid, ethyl ester 1.278 1 3
ClNO Nitrosyl chloride 1.193 2 3
C2H6N2O2 Dimethylnitroamine 1.298 1 11
H2NO3+ Nitric Acid, Protonated 1.381 1 4
FNO Nitrosyl fluoride 1.216 2 3
FNO3 Fluorine nitrate 1.255 1 4
NH2OH hydroxylamine 1.526 1 2
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 1.188 1 2
NO3 Nitrogen trioxide 1.188 1 2
NO3+ nitrogen trioxide cation 1.188 1 2
NO3- nitrate anion 1.398 1 2
NO3 Nitrogen trioxide 1.398 1 2
NO3+ nitrogen trioxide cation 1.398 1 2
ClONO2 Chlorine nitrate 1.652 2 3
    1.261 3 5
HNO3 Nitric acid 1.504 1 2
N2O5 Dinitrogen pentoxide 1.622 1 3
NO- nitric oxide anion 1.340 1 2
NO Nitric oxide 1.340 1 2
NO+ nitric oxide cation 1.340 1 2
NO- nitric oxide anion 1.366 1 2
NO Nitric oxide 1.366 1 2
NO+ nitric oxide cation 1.366 1 2
NO- nitric oxide anion 1.137 1 2
NO Nitric oxide 1.137 1 2
NO+ nitric oxide cation 1.137 1 2
NO- nitric oxide anion 1.140 1 2
NO Nitric oxide 1.140 1 2
NO+ nitric oxide cation 1.140 1 2
NO2- Nitrogen dioxide anion 1.354 1 3
NO2 Nitrogen dioxide 1.354 1 3
NO2+ Nitrogen dioxide cation 1.354 1 3
NO2- Nitrogen dioxide anion 1.271 1 3
NO2 Nitrogen dioxide 1.271 1 3
NO2+ Nitrogen dioxide cation 1.271 1 3
NO2- Nitrogen dioxide anion 1.200 1 3
NO2 Nitrogen dioxide 1.200 1 3
NO2+ Nitrogen dioxide cation 1.200 1 3
N2O3 Dinitrogen trioxide 1.286 2 4
ClNO2 Nitryl chloride 1.249 2 4
CH3NO3 Methyl nitrate 1.503 1 4
BrONO Bromine nitrite 1.230 3 4
ONONO Nitrosyl nitrite 1.242 3 5
CH3NO2 Methane, nitro- 1.304 2 6
C6H5NO2 Nitrobenzene 1.302 7 8
C2H5NO3 Nitric acid, ethyl ester 1.280 1 4
C3H3NO Isoxazole 1.494 5 8
CH3CH(CH3)ONO Iso-propyl nitrite 1.260 12 13
C2H6N2O2 Dimethylnitroamine 1.298 2 11
C4H11NO Diethylhydroxylamine 1.513 1 2
H2NO3+ Nitric Acid, Protonated 1.271 1 2
FNO3 Fluorine nitrate 1.685 1 2
F3NO Nitrogen trifluoride oxide 1.196 1 2
HNO3 Nitric acid 1.272 1 4
HNO2 Nitrous acid 1.258 3 4
HNO2+ nitrous acid cation 1.258 3 4
HNO2 Nitrous acid 1.119 3 4
HNO2+ nitrous acid cation 1.119 3 4
N2O5 Dinitrogen pentoxide 1.622 1 2
    1.264 2 4
NO2- Nitrogen dioxide anion 1.354 1 2
NO2 Nitrogen dioxide 1.354 1 2
NO2+ Nitrogen dioxide cation 1.354 1 2
NO2- Nitrogen dioxide anion 1.271 1 2
NO2 Nitrogen dioxide 1.271 1 2
NO2+ Nitrogen dioxide cation 1.271 1 2
NO2- Nitrogen dioxide anion 1.200 1 2
NO2 Nitrogen dioxide 1.200 1 2
NO2+ Nitrogen dioxide cation 1.200 1 2
N2O4 Dinitrogen tetroxide 1.267 2 6
N2O3 Dinitrogen trioxide 1.244 1 3
    1.278 2 5
BrNO Nitrosyl bromide 1.209 1 3
NO3- nitrate anion 1.271 1 4
NO3 Nitrogen trioxide 1.271 1 4
NO3+ nitrogen trioxide cation 1.271 1 4
NO3- nitrate anion 1.477 1 4
NO3 Nitrogen trioxide 1.477 1 4
NO3+ nitrogen trioxide cation 1.477 1 4
NO3- nitrate anion 1.398 1 4
NO3 Nitrogen trioxide 1.398 1 4
NO3+ nitrogen trioxide cation 1.398 1 4
HNO- Nitrosyl hydride anion 1.425 2 3
HNO Nitrosyl hydride 1.425 2 3
HNO+ Nitrosyl hydride cation 1.425 2 3
HNO- Nitrosyl hydride anion 1.330 2 3
HNO Nitrosyl hydride 1.330 2 3
HNO+ Nitrosyl hydride cation 1.330 2 3
HNO- Nitrosyl hydride anion 1.184 2 3
HNO Nitrosyl hydride 1.184 2 3
HNO+ Nitrosyl hydride cation 1.184 2 3
C4H5NO 3-Methylisoxazole 1.493 6 7
CNO- fulminate 1.325 1 3
ONONO Nitrosyl nitrite 1.599 1 2
    1.242 2 4