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III.G.1.a.

Compare Calculated Bonds for N-O

BLYP/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
1.325 0.123

  Species Name Bond Length (Å)
Lowest value CH3NHCH2COOH Sarcosine 1.101
Highest value HOONO2 peroxy nitric acid 1.667

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CH3NHCH2COOH Sarcosine 1.101 2 10
C3H7ONO Propyl nitrite 1.582 4 5
    1.473 4 5
CH3NO3 Methyl nitrate 1.558 1 4
FNO Nitrosyl fluoride 1.207 2 3
FNO3 Fluorine nitrate 1.260 1 4
NH2OH hydroxylamine 1.551 1 2
NO- nitric oxide anion 1.371 1 2
NO Nitric oxide 1.371 1 2
NO+ nitric oxide cation 1.371 1 2
NO- nitric oxide anion 1.373 1 2
NO Nitric oxide 1.373 1 2
NO+ nitric oxide cation 1.373 1 2
NO- nitric oxide anion 1.219 1 2
NO Nitric oxide 1.219 1 2
NO+ nitric oxide cation 1.219 1 2
NO- nitric oxide anion 1.103 1 2
NO Nitric oxide 1.103 1 2
NO+ nitric oxide cation 1.103 1 2
NO2- Nitrogen dioxide anion 1.370 1 3
NO2 Nitrogen dioxide 1.370 1 3
NO2+ Nitrogen dioxide cation 1.370 1 3
NO2- Nitrogen dioxide anion 1.278 1 3
NO2 Nitrogen dioxide 1.278 1 3
NO2+ Nitrogen dioxide cation 1.278 1 3
NO2- Nitrogen dioxide anion 1.176 1 3
NO2 Nitrogen dioxide 1.176 1 3
NO2+ Nitrogen dioxide cation 1.176 1 3
N2O3 Dinitrogen trioxide 1.281 2 4
C2H5NO3 Nitric acid, ethyl ester 1.268 1 3
H2NO3+ Nitric Acid, Protonated 1.428 1 4
HNO3 Nitric acid 1.541 1 2
NO3- nitrate anion 1.324 1 2
NO3 Nitrogen trioxide 1.324 1 2
NO3+ nitrogen trioxide cation 1.324 1 2
NO3- nitrate anion 1.323 1 2
NO3 Nitrogen trioxide 1.323 1 2
NO3+ nitrogen trioxide cation 1.323 1 2
NO3- nitrate anion 1.182 1 2
NO3 Nitrogen trioxide 1.182 1 2
NO3+ nitrogen trioxide cation 1.182 1 2
NO3- nitrate anion 1.324 1 2
NO3 Nitrogen trioxide 1.324 1 2
NO3+ nitrogen trioxide cation 1.324 1 2
ClNO2 Nitryl chloride 1.256 2 4
ClNO Nitrosyl chloride 1.196 2 3
ClONO2 Chlorine nitrate 1.644 2 3
    1.263 3 5
BrONO Bromine nitrite 1.220 3 4
ONONO Nitrosyl nitrite 1.222 3 5
CH3NO2 Methane, nitro- 1.300 2 7
C6H5NO2 Nitrobenzene 1.307 7 9
C3H7ONO Propyl nitrite 1.234 5 6
    1.233 5 6
HCNO fulminic acid 1.261 1 2
CH3NO3 Methyl nitrate 1.268 1 3
CH3ONO Methyl nitrite 1.550 2 6
C2H5NO3 Nitric acid, ethyl ester 1.554 1 2
HNO3 Nitric acid 1.285 1 3
ClNO2 Nitryl chloride 1.256 2 3
ClONO2 Chlorine nitrate 1.258 3 4
HOONO2 peroxy nitric acid 1.667 1 2
    1.267 1 5
C2H6N2O2 (E)-Azodioxymethane 1.337 1 3
BrONO Bromine nitrite 1.643 2 3
CH3CHNOH Acetaldoxime 1.511 3 4
CH3NO3 Methyl nitrate 1.281 1 2
FNO3 Fluorine nitrate 1.253 1 3
CH3ONO Methyl nitrite 1.247 6 7
H2NO3+ Nitric Acid, Protonated 1.428 1 3
HNO2 Nitrous acid 1.574 2 3
HNO2+ nitrous acid cation 1.574 2 3
HNO2 Nitrous acid 1.452 2 3
HNO2+ nitrous acid cation 1.452 2 3
NO3- nitrate anion 1.324 1 3
NO3 Nitrogen trioxide 1.324 1 3
NO3+ nitrogen trioxide cation 1.324 1 3
NO3- nitrate anion 1.324 1 3
NO3 Nitrogen trioxide 1.324 1 3
NO3+ nitrogen trioxide cation 1.324 1 3
NO3- nitrate anion 1.476 1 3
NO3 Nitrogen trioxide 1.476 1 3
NO3+ nitrogen trioxide cation 1.476 1 3
NO3- nitrate anion 1.324 1 3
NO3 Nitrogen trioxide 1.324 1 3
NO3+ nitrogen trioxide cation 1.324 1 3
HOONO2 peroxy nitric acid 1.262 1 4
N2O Nitrous oxide 1.246 2 3
N2O+ Nitrous oxide cation 1.246 2 3
N2O- Nitrous oxide anion 1.246 2 3
N2O Nitrous oxide 1.281 2 3
N2O+ Nitrous oxide cation 1.281 2 3
N2O- Nitrous oxide anion 1.281 2 3
C2H6N2O2 (E)-Azodioxymethane 1.337 2 4
NH3O Ammonia Oxide 1.416 1 2
ONONO Nitrosyl nitrite 1.628 1 3
CH3NO2 Methane, nitro- 1.300 2 6
C6H5NO2 Nitrobenzene 1.307 7 8
C3H3NO Isoxazole 1.524 5 8
C2H5NO3 Nitric acid, ethyl ester 1.282 1 4
H2NO3+ Nitric Acid, Protonated 1.234 1 2
HNO3 Nitric acid 1.264 1 4
HNO2 Nitrous acid 1.231 3 4
HNO2+ nitrous acid cation 1.231 3 4
HNO2 Nitrous acid 1.189 3 4
HNO2+ nitrous acid cation 1.189 3 4
NO3- nitrate anion 1.324 1 4
NO3 Nitrogen trioxide 1.324 1 4
NO3+ nitrogen trioxide cation 1.324 1 4
NO3- nitrate anion 1.324 1 4
NO3 Nitrogen trioxide 1.324 1 4
NO3+ nitrogen trioxide cation 1.324 1 4
NO3- nitrate anion 1.476 1 4
NO3 Nitrogen trioxide 1.476 1 4
NO3+ nitrogen trioxide cation 1.476 1 4
NO3- nitrate anion 1.324 1 4
NO3 Nitrogen trioxide 1.324 1 4
NO3+ nitrogen trioxide cation 1.324 1 4
FNO3 Fluorine nitrate 1.665 1 2
NO2- Nitrogen dioxide anion 1.370 1 2
NO2 Nitrogen dioxide 1.370 1 2
NO2+ Nitrogen dioxide cation 1.370 1 2
NO2- Nitrogen dioxide anion 1.278 1 2
NO2 Nitrogen dioxide 1.278 1 2
NO2+ Nitrogen dioxide cation 1.278 1 2
NO2- Nitrogen dioxide anion 1.176 1 2
NO2 Nitrogen dioxide 1.176 1 2
NO2+ Nitrogen dioxide cation 1.176 1 2
N2O3 Dinitrogen trioxide 1.205 1 3
    1.273 2 5
BrNO Nitrosyl bromide 1.209 1 3
HNO- Nitrosyl hydride anion 1.406 2 3
HNO Nitrosyl hydride 1.406 2 3
HNO+ Nitrosyl hydride cation 1.406 2 3
HNO- Nitrosyl hydride anion 1.281 2 3
HNO Nitrosyl hydride 1.281 2 3
HNO+ Nitrosyl hydride cation 1.281 2 3
HNO- Nitrosyl hydride anion 1.182 2 3
HNO Nitrosyl hydride 1.182 2 3
HNO+ Nitrosyl hydride cation 1.182 2 3
F3NO Nitrogen trifluoride oxide 1.217 1 2
CNO- fulminate 1.335 1 3
ONONO Nitrosyl nitrite 1.628 1 2
    1.222 2 4