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III.G.1.a.

Compare Calculated Bonds for N-O

CBS-Q

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


Values greater than 4.50 are in the 4.50 bin. Values less than 1.00 are in the 1.00 bin.

histogram chart 100 line line line line line line line line line line line line line line line line line line line line line line line line
histogram chart 80 line histogram chart line line line line line line line line line line line line line line line line line line line line line line
histogram chart 60 line histogram chart line line line line line line line line line line line line line line line line line line line line line line
histogram chart 40 line histogram chart line line line line line line line line line line line line line line line line line line line line line line
histogram chart 20 line histogram chart line line histogram chart line line line line line line line line line line line line line line line line line line line
histogram chart 0 line histogram chart line line histogram chart line line histogram chart line line histogram chart line line line line line histogram chart line line line line line line line
1.00 1.50 2.00 2.50 3.00 3.50 4.00 4.50
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.252 0.329

  Species Name Bond Length (Å)
Lowest value NO- nitric oxide anion 1.032
Highest value CH3ONO Methyl nitrite 3.628

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CH3NHCH2COOH Sarcosine 1.086 2 10
C3H3NO Isoxazole 1.355 5 8
CH3NO3 Methyl nitrate 1.180 1 2
    1.170 1 3
    1.329 1 4
ClNO Nitrosyl chloride 1.101 2 3
H2NO3+ Nitric Acid, Protonated 1.137 1 2
    1.273 1 3
    1.273 1 4
FNO Nitrosyl fluoride 1.120 2 3
FNO3 Fluorine nitrate 1.388 1 2
    1.158 1 3
    1.163 1 4
F3NO Nitrogen trifluoride oxide 1.164 1 2
ClONO2 Chlorine nitrate 1.370 2 3
    1.166 3 4
    1.166 3 5
ONONO Nitrosyl nitrite 1.415 1 2
    1.415 1 3
    1.128 2 4
    1.128 3 5
CH3CHNOH Acetaldoxime 1.370 3 4
C3H7ONO Propyl nitrite 1.333 4 5
    1.150 5 6
    1.335 4 5
    1.146 5 6
CH3ONO Methyl nitrite 3.628 2 6
    1.774 6 7
NO2- Nitrogen dioxide anion 1.223 1 2
NO2 Nitrogen dioxide 1.223 1 2
NO2+ Nitrogen dioxide cation 1.223 1 2
NO2- Nitrogen dioxide anion 1.223 1 3
NO2 Nitrogen dioxide 1.223 1 3
NO2+ Nitrogen dioxide cation 1.223 1 3
NO2- Nitrogen dioxide anion 1.157 1 2
NO2 Nitrogen dioxide 1.157 1 2
NO2+ Nitrogen dioxide cation 1.157 1 2
NO2- Nitrogen dioxide anion 1.157 1 3
NO2 Nitrogen dioxide 1.157 1 3
NO2+ Nitrogen dioxide cation 1.157 1 3
NO2- Nitrogen dioxide anion 1.083 1 2
NO2 Nitrogen dioxide 1.083 1 2
NO2+ Nitrogen dioxide cation 1.083 1 2
NO2- Nitrogen dioxide anion 1.083 1 3
NO2 Nitrogen dioxide 1.083 1 3
NO2+ Nitrogen dioxide cation 1.083 1 3
N2O3 Dinitrogen trioxide 1.122 1 3
    1.168 2 4
    1.170 2 5
ClNO2 Nitryl chloride 1.165 2 3
    1.165 2 4
NH3O Ammonia Oxide 1.367 1 2
BrONO Bromine nitrite 1.377 2 3
    1.137 3 4
HCNO fulminic acid 1.193 1 2
HNO2 Nitrous acid 1.322 2 3
HNO2+ nitrous acid cation 1.322 2 3
HNO2 Nitrous acid 1.154 3 4
HNO2+ nitrous acid cation 1.154 3 4
HNO2 Nitrous acid 1.253 2 3
HNO2+ nitrous acid cation 1.253 2 3
HNO2 Nitrous acid 1.123 3 4
HNO2+ nitrous acid cation 1.123 3 4
NH2OH hydroxylamine 1.397 1 2
N2O- Nitrous oxide anion 1.170 2 3
N2O Nitrous oxide 1.170 2 3
N2O+ Nitrous oxide cation 1.170 2 3
N2O- Nitrous oxide anion 1.223 2 3
N2O Nitrous oxide 1.223 2 3
N2O+ Nitrous oxide cation 1.223 2 3
BrNO Nitrosyl bromide 1.103 1 3
HOONO2 peroxy nitric acid 1.369 1 2
    1.166 1 4
    1.169 1 5
CNO- fulminate 1.268 1 3
CH3NO2 Methane, nitro- 1.185 2 6
    1.185 2 7
HNO3 Nitric acid 1.332 1 2
    1.181 1 3
    1.165 1 4
NO- nitric oxide anion 1.241 1 2
NO Nitric oxide 1.241 1 2
NO+ nitric oxide cation 1.241 1 2
NO- nitric oxide anion 1.230 1 2
NO Nitric oxide 1.230 1 2
NO+ nitric oxide cation 1.230 1 2
NO- nitric oxide anion 1.119 1 2
NO Nitric oxide 1.119 1 2
NO+ nitric oxide cation 1.119 1 2
NO- nitric oxide anion 1.032 1 2
NO Nitric oxide 1.032 1 2
NO+ nitric oxide cation 1.032 1 2
NO3- nitrate anion 2.747 1 2
NO3 Nitrogen trioxide 2.747 1 2
NO3+ nitrogen trioxide cation 2.747 1 2
NO3- nitrate anion 1.082 1 3
NO3 Nitrogen trioxide 1.082 1 3
NO3+ nitrogen trioxide cation 1.082 1 3
NO3- nitrate anion 1.082 1 4
NO3 Nitrogen trioxide 1.082 1 4
NO3+ nitrogen trioxide cation 1.082 1 4
NO3- nitrate anion 1.103 1 2
NO3 Nitrogen trioxide 1.103 1 2
NO3+ nitrogen trioxide cation 1.103 1 2
NO3- nitrate anion 1.265 1 3
NO3 Nitrogen trioxide 1.265 1 3
NO3+ nitrogen trioxide cation 1.265 1 3
NO3- nitrate anion 1.265 1 4
NO3 Nitrogen trioxide 1.265 1 4
NO3+ nitrogen trioxide cation 1.265 1 4
NO3- nitrate anion 1.173 1 2
NO3 Nitrogen trioxide 1.173 1 2
NO3+ nitrogen trioxide cation 1.173 1 2
NO3- nitrate anion 1.173 1 3
NO3 Nitrogen trioxide 1.173 1 3
NO3+ nitrogen trioxide cation 1.173 1 3
NO3- nitrate anion 1.173 1 4
NO3 Nitrogen trioxide 1.173 1 4
NO3+ nitrogen trioxide cation 1.173 1 4
HNO- Nitrosyl hydride anion 1.294 2 3
HNO Nitrosyl hydride 1.294 2 3
HNO+ Nitrosyl hydride cation 1.294 2 3
HNO- Nitrosyl hydride anion 1.168 2 3
HNO Nitrosyl hydride 1.168 2 3
HNO+ Nitrosyl hydride cation 1.168 2 3
HNO- Nitrosyl hydride anion 1.097 2 3
HNO Nitrosyl hydride 1.097 2 3
HNO+ Nitrosyl hydride cation 1.097 2 3
C2H6N2O2 (E)-Azodioxymethane 1.250 1 3
    1.250 2 4