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III.G.1.a.

Compare Calculated Bonds for N-O

mPW1PW91/6-31G**

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
1.235 0.088

  Species Name Bond Length (Å)
Lowest value NO- nitric oxide anion 1.068
Highest value FNO3 Fluorine nitrate 1.473

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CH3NHCH2COOH Sarcosine 1.092 2 10
C3H7ONO Propyl nitrite 1.390 4 5
    1.377 4 5
C2H5NO3 Nitric acid, ethyl ester 1.200 1 3
C2H6N2O2 Dimethylnitroamine 1.223 1 11
CH3NO3 Methyl nitrate 1.392 1 4
FNO Nitrosyl fluoride 1.146 2 3
FNO3 Fluorine nitrate 1.191 1 4
NH2OH hydroxylamine 1.428 1 2
NO3- nitrate anion 1.202 1 2
NO3 Nitrogen trioxide 1.202 1 2
NO3+ nitrogen trioxide cation 1.202 1 2
NO3- nitrate anion 1.217 1 2
NO3 Nitrogen trioxide 1.217 1 2
NO3+ nitrogen trioxide cation 1.217 1 2
NO3- nitrate anion 1.137 1 2
NO3 Nitrogen trioxide 1.137 1 2
NO3+ nitrogen trioxide cation 1.137 1 2
NO3- nitrate anion 1.217 1 2
NO3 Nitrogen trioxide 1.217 1 2
NO3+ nitrogen trioxide cation 1.217 1 2
ClNO2 Nitryl chloride 1.188 2 4
NO- nitric oxide anion 1.269 1 2
NO Nitric oxide 1.269 1 2
NO+ nitric oxide cation 1.269 1 2
NO- nitric oxide anion 1.265 1 2
NO Nitric oxide 1.265 1 2
NO+ nitric oxide cation 1.265 1 2
NO- nitric oxide anion 1.152 1 2
NO Nitric oxide 1.152 1 2
NO+ nitric oxide cation 1.152 1 2
NO- nitric oxide anion 1.068 1 2
NO Nitric oxide 1.068 1 2
NO+ nitric oxide cation 1.068 1 2
NO2- Nitrogen dioxide anion 1.261 1 3
NO2 Nitrogen dioxide 1.261 1 3
NO2+ Nitrogen dioxide cation 1.261 1 3
NO2- Nitrogen dioxide anion 1.194 1 3
NO2 Nitrogen dioxide 1.194 1 3
NO2+ Nitrogen dioxide cation 1.194 1 3
NO2- Nitrogen dioxide anion 1.122 1 3
NO2 Nitrogen dioxide 1.122 1 3
NO2+ Nitrogen dioxide cation 1.122 1 3
N2O3 Dinitrogen trioxide 1.199 2 4
ClONO2 Chlorine nitrate 1.466 2 3
    1.192 3 5
H2NO3+ Nitric Acid, Protonated 1.301 1 4
HNO3 Nitric acid 1.386 1 2
BrONO Bromine nitrite 1.165 3 4
ONONO Nitrosyl nitrite 1.164 3 5
CH3CHNOH Acetaldoxime 1.390 3 4
CH3ONO Methyl nitrite 1.186 6 7
CH3NO3 Methyl nitrate 1.207 1 2
H2NO3+ Nitric Acid, Protonated 1.301 1 3
FNO3 Fluorine nitrate 1.184 1 3
NO3- nitrate anion 1.248 1 3
NO3 Nitrogen trioxide 1.248 1 3
NO3+ nitrogen trioxide cation 1.248 1 3
NO3- nitrate anion 1.217 1 3
NO3 Nitrogen trioxide 1.217 1 3
NO3+ nitrogen trioxide cation 1.217 1 3
NO3- nitrate anion 1.309 1 3
NO3 Nitrogen trioxide 1.309 1 3
NO3+ nitrogen trioxide cation 1.309 1 3
NO3- nitrate anion 1.217 1 3
NO3 Nitrogen trioxide 1.217 1 3
NO3+ nitrogen trioxide cation 1.217 1 3
N2O Nitrous oxide 1.184 2 3
N2O+ Nitrous oxide cation 1.184 2 3
N2O- Nitrous oxide anion 1.184 2 3
N2O Nitrous oxide 1.190 2 3
N2O+ Nitrous oxide cation 1.190 2 3
N2O- Nitrous oxide anion 1.190 2 3
N2O4 Dinitrogen tetroxide 1.188 1 4
HOONO2 peroxy nitric acid 1.193 1 4
HNO2 Nitrous acid 1.399 2 3
HNO2+ nitrous acid cation 1.399 2 3
HNO2 Nitrous acid 1.282 2 3
HNO2+ nitrous acid cation 1.282 2 3
C2H6N2O2 (E)-Azodioxymethane 1.259 2 4
NH3O Ammonia Oxide 1.334 1 2
ONONO Nitrosyl nitrite 1.454 1 3
CH3NO2 Methane, nitro- 1.218 2 6
CH3CH(CH3)ONO Iso-propyl nitrite 1.179 12 13
C3H3NO Isoxazole 1.378 5 8
C2H5NO3 Nitric acid, ethyl ester 1.208 1 4
C2H6N2O2 Dimethylnitroamine 1.223 2 11
FNO3 Fluorine nitrate 1.473 1 2
NO3- nitrate anion 1.248 1 4
NO3 Nitrogen trioxide 1.248 1 4
NO3+ nitrogen trioxide cation 1.248 1 4
NO3- nitrate anion 1.217 1 4
NO3 Nitrogen trioxide 1.217 1 4
NO3+ nitrogen trioxide cation 1.217 1 4
NO3- nitrate anion 1.309 1 4
NO3 Nitrogen trioxide 1.309 1 4
NO3+ nitrogen trioxide cation 1.309 1 4
NO3- nitrate anion 1.217 1 4
NO3 Nitrogen trioxide 1.217 1 4
NO3+ nitrogen trioxide cation 1.217 1 4
BrNO Nitrosyl bromide 1.140 1 3
C4H11NO Diethylhydroxylamine 1.412 1 2
NO2- Nitrogen dioxide anion 1.261 1 2
NO2 Nitrogen dioxide 1.261 1 2
NO2+ Nitrogen dioxide cation 1.261 1 2
NO2- Nitrogen dioxide anion 1.194 1 2
NO2 Nitrogen dioxide 1.194 1 2
NO2+ Nitrogen dioxide cation 1.194 1 2
NO2- Nitrogen dioxide anion 1.122 1 2
NO2 Nitrogen dioxide 1.122 1 2
NO2+ Nitrogen dioxide cation 1.122 1 2
N2O4 Dinitrogen tetroxide 1.188 2 6
N2O3 Dinitrogen trioxide 1.144 1 3
    1.199 2 5
HNO- Nitrosyl hydride anion 1.320 2 3
HNO Nitrosyl hydride 1.320 2 3
HNO+ Nitrosyl hydride cation 1.320 2 3
HNO- Nitrosyl hydride anion 1.200 2 3
HNO Nitrosyl hydride 1.200 2 3
HNO+ Nitrosyl hydride cation 1.200 2 3
HNO- Nitrosyl hydride anion 1.127 2 3
HNO Nitrosyl hydride 1.127 2 3
HNO+ Nitrosyl hydride cation 1.127 2 3
H2NO3+ Nitric Acid, Protonated 1.173 1 2
HNO3 Nitric acid 1.195 1 4
HNO2 Nitrous acid 1.175 3 4
HNO2+ nitrous acid cation 1.175 3 4
HNO2 Nitrous acid 1.144 3 4
HNO2+ nitrous acid cation 1.144 3 4
F3NO Nitrogen trifluoride oxide 1.165 1 2
C4H5NO 3-Methylisoxazole 1.380 6 7
CNO- fulminate 1.262 1 3
ONONO Nitrosyl nitrite 1.454 1 2
    1.164 2 4
CH3NO2 Methane, nitro- 1.218 2 7
CH3CH(CH3)ONO Iso-propyl nitrite 1.391 11 13
CH3NO3 Methyl nitrate 1.199 1 3
C3H7ONO Propyl nitrite 1.179 5 6
    1.182 5 6
CH3ONO Methyl nitrite 1.373 2 6
C2H5NO3 Nitric acid, ethyl ester 1.388 1 2
HCNO fulminic acid 1.200 1 2
ClNO2 Nitryl chloride 1.188 2 3
N2O4 Dinitrogen tetroxide 1.188 1 3
    1.188 2 5
ClONO2 Chlorine nitrate 1.189 3 4
HOONO2 peroxy nitric acid 1.472 1 2
    1.192 1 5
C4H5NO Isoxazole, 5-methyl- 1.381 6 7
HNO3 Nitric acid 1.210 1 3
C2H6N2O2 (E)-Azodioxymethane 1.259 1 3
BrONO Bromine nitrite 1.447 2 3