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III.G.1.a.

Compare Calculated Bonds for N-O

MP2=FULL/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
1.332 0.129

  Species Name Bond Length (Å)
Lowest value CH3NHCH2COOH Sarcosine 1.093
Highest value BrONO Bromine nitrite 1.664

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
C3H7ONO Propyl nitrite 1.520 4 5
    1.457 4 5
CH3NHCH2COOH Sarcosine 1.093 2 10
C2H5NO3 Nitric acid, ethyl ester 1.278 1 3
H2NO3+ Nitric Acid, Protonated 1.381 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
NO- nitric oxide anion 1.339 1 2
NO Nitric oxide 1.339 1 2
NO+ nitric oxide cation 1.339 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 1.200 1 3
NO2 Nitrogen dioxide 1.200 1 3
NO2+ Nitrogen dioxide cation 1.200 1 3
N2O3 Dinitrogen trioxide 1.286 2 4
ClONO2 Chlorine nitrate 1.661 2 3
    1.259 3 5
BrONO Bromine nitrite 1.218 3 4
ONONO Nitrosyl nitrite 1.242 3 5
CH3ONO Methyl nitrite 1.274 6 7
H2NO3+ Nitric Acid, Protonated 1.381 1 3
HNO2 Nitrous acid 1.376 2 3
HNO2+ nitrous acid cation 1.376 2 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
HOONO2 peroxy nitric acid 1.262 1 4
N2O Nitrous oxide 1.409 2 3
N2O+ Nitrous oxide cation 1.409 2 3
N2O- Nitrous oxide anion 1.409 2 3
C2H6N2O2 (E)-Azodioxymethane 1.312 2 4
NH3O Ammonia Oxide 1.508 1 2
ONONO Nitrosyl nitrite 1.599 1 3
C6H5NO2 Nitrobenzene 1.302 7 8
C2H5NO3 Nitric acid, ethyl ester 1.280 1 4
HNO2 Nitrous acid 1.119 3 4
HNO2+ nitrous acid cation 1.119 3 4
H2NO3+ Nitric Acid, Protonated 1.271 1 2
BrNO Nitrosyl bromide 1.201 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
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 1.200 1 2
NO2 Nitrogen dioxide 1.200 1 2
NO2+ Nitrogen dioxide cation 1.200 1 2
N2O3 Dinitrogen trioxide 1.244 1 3
    1.278 2 5
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 1.184 2 3
HNO Nitrosyl hydride 1.184 2 3
HNO+ Nitrosyl hydride cation 1.184 2 3
CNO- fulminate 1.325 1 3
ONONO Nitrosyl nitrite 1.599 1 2
    1.242 2 4
C6H5NO2 Nitrobenzene 1.302 7 9
C3H7ONO Propyl nitrite 1.261 5 6
    1.238 5 6
HCNO fulminic acid 1.245 1 2
CH3ONO Methyl nitrite 1.484 2 6
C2H5NO3 Nitric acid, ethyl ester 1.500 1 2
HOONO2 peroxy nitric acid 1.637 1 2
    1.256 1 5
ClONO2 Chlorine nitrate 1.250 3 4
C2H6N2O2 (E)-Azodioxymethane 1.312 1 3
BrONO Bromine nitrite 1.664 2 3