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Compare Calculated Bonds for C-O

17 01 10 14 40

G3

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


Values greater than 5.00 are in the 5.00 bin. Values less than 1.00 are in the 1.00 bin.

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1.00 1.50 2.00 2.50 3.00 3.50 4.00 4.50 5.00
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.315 0.218

  Species Name Bond Length (Å)
Lowest value HCO+ Formyl cation 1.087
Highest value C4H7NO Methacrylamide 4.105

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CO- carbon monoxide anion 1.217 1 2
CO Carbon monoxide 1.114 1 2
CO+ carbon monoxide cation 1.098 1 2
HCO- formyl anion 1.227 1 3
HCO Formyl radical 1.159 1 3
HCO+ Formyl cation 1.087 1 3
COH Hydroxymethylidyne 1.273 1 2
COH+ Carbon Monoxide, protonated 1.142 1 2
H2CO- formaldehyde anion 1.288 1 2
H2CO Formaldehyde 1.184 1 2
H2CO+ formaldehyde cation 1.212 1 2
HOCH hydroxycarbene 1.300 1 2
CH3O- methoxy anion 1.311 1 2
CH3O+ Methoxy cation 1.329 1 2
CH2OH Hydroxymethyl radical 1.359 1 2
CH2OH+ hydroxymethyl cation 1.232 1 2
CH3OH- Methyl alcohol anion 1.384 1 2
CH3OH Methyl alcohol 1.399 1 2
CH3OH+ Methyl alcohol cation 1.477 1 2
CH3OH2+ Methanol, protonated 1.511 1 2
CO2 Carbon dioxide 1.143 1 2
    1.143 1 3
CCO Dicarbon monoxide 1.140 2 3
NCO isocyanato radical 1.160 2 3
OCS Carbonyl sulfide 1.131 1 2
OCSe Carbonyl selenide 1.126 1 2
FCO Carbonyl fluoride 1.153 2 3
FCO+ Carbonyl fluoride cation 1.093 2 3
ClCO carbonyl monochloride 1.135 2 3
HOCO Hydrocarboxyl radical 1.322 1 2
    1.161 1 3
HCOO formate neutral radical 1.177 1 3
    1.324 1 4
HFCO+ formyl fluoride cation 1.241 1 2
COHCl Formyl chloride 1.165 1 2
COHBr Formyl bromide 1.162 1 2
HCOOH Formic acid 1.323 1 2
    1.182 1 3
C2H2O Oxirene 1.467 1 2
    1.467 1 3
CH2CO Ketene 1.145 2 3
H2COO Dioxymethyl radical 2.262 2 5
    1.200 1 2
H2COO+ dioxymethyl cation 2.219 2 5
    1.231 1 2
CHONH2 formamide 1.193 1 2
CH3OO- methylperoxy anion 1.357 1 2
CH3OO methylperoxy radical 1.416 1 2
CH3OO+ methylperoxy cation 1.552 1 2
CH3CO Acetyl radical 1.165 2 3
CH3CO+ acetyl cation 1.095 2 3
CH2CHO Vinyloxy radical 1.237 1 4
CNOH3 1,2-oxaziridine 1.373 1 3
CH2OOH CH2OOH radical 1.361 1 2
HOCHNH hydroxymethylimine 1.329 1 2
BH3CO Borane carbonyl 1.110 2 3
CH2COH+ ketene, protonated 1.216 2 3
NaOCH3 Sodium methoxide 1.354 2 3
CH2FOH fluoromethanol 1.364 1 3
CH3OCl methyl hypochlorite 1.411 1 3
CH3CHO Acetaldehyde 1.188 1 3
CH3CHO+ acetaldehyde cation 1.221 1 3
C2H4O Ethylene oxide 1.401 1 2
    1.401 1 3
C2H4O+ ethylene oxide cation 1.499 1 2
    1.499 1 3
CH2(OH)2 methanediol 1.386 1 2
    1.386 1 3
H2CONH2+ protonated formamide 1.270 1 2
NH2CHOH+ Formamide, O-protonated 1.270 1 2
H2COCH2+ Methyl, (methyleneoxoniumyl)- 1.293 1 2
    1.293 1 3
CH3CH2O Ethoxy radical 1.388 2 3
CH3CHOH 1-hydroxy-ethyl radical 1.366 1 3
CH3CHOH+ acetaldehyde, protonated 1.245 1 3
NH2CH2OH aminomethanol 1.404 2 3
CH2CH2OH 2-hydroxy ethyl radical 1.405 1 2
C2H4OH+ ethylene oxide, protonated 1.497 1 3
    1.497 1 4
CH3OCH2 methoxymethyl radical 1.399 1 2
    1.351 1 3
C3O Tricarbon monoxide 1.129 3 4
CF2O Carbonic difluoride 1.157 1 2
CF2O+ Carbonic difluoride cation 1.258 1 2
COFCl Carbonic chloride fluoride 1.158 1 2
COBr2 Carbonic dibromide 1.155 1 2
C2H2O2 Ethanedial 1.185 1 5
    1.185 2 6
H2CO3 Carbonic acid 1.188 1 2
    1.315 1 3
    1.315 1 4
C3H2O Propadienal 1.156 3 4
HOCH2CN cyanomethanol 1.388 1 3
NH2COOH Carbamic acid 1.194 1 2
    1.334 1 4
CH3NCO methylisocyante 1.158 3 4
H3CO3+ carbonic acid, protonated 1.263 1 2
    1.263 1 3
    1.263 1 4
CH2ClCHO chloroacetaldehyde 1.184 2 4
NH2CONH2 Urea 1.202 1 2
CH2CHCHO Acrolein 1.190 1 4
C3H4O Cyclopropanone 1.179 1 2
NH3COOH+ protonated Carbamic acid 1.160 1 2
    1.292 1 4
C2H4O2 1,3-dioxetane 1.404 1 3
    1.404 1 4
    1.404 2 3
    1.404 2 4
NH2COOH2+ Carbamic acid, O-protonated 1.281 1 2
    1.274 1 4
CH3CONH2 Acetamide 1.197 2 4
HCONHCH3 N-methylformamide 1.195 1 2
CH3COCH2 Acetonyl radical 1.228 1 2
C2H5OO ethylperoxy radical 1.425 2 3
CH5N2O+ urea, N-protonated 1.167 1 2
CH3C(OH)=NH Ethaninidic acid 1.338 1 4
CH2C(OH)NH2 1-amino vinyl alchohol 1.347 1 4
H2NCOHNH2+ urea, protonated 1.292 1 2
CH2FCH2OH 2-fluoroethanol 1.397 1 3
CH2ClCH2OH 2-Chloroethanol 1.404 1 4
CH3COCH3- acetone anion 1.290 1 2
C3H6O Propylene oxide 1.404 1 6
    1.405 1 8
C3H6O 2-Propen-1-ol 1.405 1 4
CH3CH2CHO Propanal 1.188 3 4
C3H6O Oxetane 1.419 1 3
    1.419 1 4
C3H5OH Cyclopropanol 1.385 1 4
C3H6O Acetone enol 1.354 2 4
CH2ClCH2OH2+ 2-chloroethanol, protonated 1.536 1 4
HOCH2CH2NH2 monoethanolamine 1.395 3 4
C3H7OH 1-Propanol 1.405 3 4
CH3OC2H5 Ethane, methoxy- 1.391 1 2
    1.397 2 3
C3O2 Carbon suboxide 1.140 2 4
    1.140 3 5
BeCO3 Beryllium Carbonate 1.171 1 2
    1.361 1 4
    1.361 1 5
MgCO3 Magnesium Carbonate 1.188 1 2
    1.343 1 4
    1.343 1 5
CF3OH trifluoromethanol 1.331 1 2
CHOCOOH oxo acetic acid 1.186 1 3
    1.180 2 4
    1.315 2 5
C3H2O2 Propiolic acid 1.324 1 4
    1.183 1 5
CHOOCHO diformyl ether 1.170 2 4
    1.170 3 5
    1.348 1 2
    1.348 1 3
CHCl2CHO dichloroacetaldehyde 1.181 2 6
C3H3NO Isoxazole 1.320 3 5
C3H3NO Oxazole 1.330 1 2
    1.354 1 5
C3H4O2 β–Propiolactone 1.172 2 3
    1.343 1 2
    1.438 1 7
C3H4O2 Methyl glyoxal 1.185 1 4
    1.190 2 5
C3H4O2 2-Propenoic acid 1.331 1 4
    1.189 3 4
HOCH2COOH Hydroxyacetic acid 1.388 1 5
    1.321 2 3
    1.187 2 4
C4H4O Furan 1.344 1 2
    1.344 1 3
C2H4O3 trioxolane124 2.161 2 4
    2.161 3 5
    1.394 1 2
    1.394 1 3
CH3COCCH 3-butyn-2-one 1.189 2 3
C2H4O3 1,2,3-trioxolane 1.406 2 4
    1.406 3 5
HOCHCCHOH allenediol 1.354 2 4
    1.354 3 5
CH3OCH2CN Methoxyacetonitrile 1.403 1 2
    1.380 2 3
CH3CH2COOH Propanoic Acid 1.333 1 4
    1.186 1 5
CH2CHOCHCH2 Vinyl ether 1.352 1 2
    1.359 1 3
HCOOC2H5 Ethyl formate 1.428 2 3
    1.184 4 5
    1.315 3 4
C3H6O2 1,3-Dioxolane 1.395 1 4
    1.395 1 5
    1.404 2 4
    1.404 3 5
C4H6O cis-2-butenal 1.192 1 5
C3H7NO dimethylformamide 1.196 1 2
C3H8O2 1,3-Propanediol 1.411 2 6
    1.397 3 7
C4H10O 1-Butanol 1.406 1 5
C4H10O Ethanol, 1,1-dimethyl- 1.415 1 15
C4H10O Methyl propyl ether 1.391 1 2
    1.396 2 3
C4H10O Propane, 2-methoxy- 1.394 1 5
    1.409 5 14
CF3OF Trifluoromethylhypofluorite 1.367 1 2
ClCOClCO Oxalyl chloride 1.165 1 3
    1.165 2 4
CF3CHO trifluoroacetaldehyde 1.178 2 3
CCl3CHO trichloroacetaldehyde 1.174 2 3
C2H2O4 Oxalic Acid 1.316 1 3
    1.212 1 5
    1.316 2 4
    1.212 2 6
C3H2O3 vinylene carbonate 1.172 1 2
    1.339 1 3
    1.339 1 4
    1.371 3 5
    1.371 4 6
C2H3NO3 Oxamic acid 1.183 1 4
    1.308 1 5
    1.201 2 3
C4H3ClO Furan, 2-chloro 1.334 1 5
    1.352 4 5
C2H4CO3 Ethylene carbonate 1.165 1 2
    1.337 1 3
    1.337 1 4
    1.400 3 5
    1.400 4 6
C2H5NO3 Nitric acid, ethyl ester 1.439 2 5
C4H6O2 γ–Butyrolactone 1.335 1 5
    1.180 1 6
    1.419 4 5
C4H6O2 Crotonic Acid 1.334 1 5
    1.190 1 6
C3H6O3 1,3,5-Trioxane 1.387 1 4
    1.387 1 5
    1.387 2 4
    1.387 2 6
    1.387 3 5
    1.387 3 6
C5H6O 2H-Pyran 1.345 1 2
    1.416 1 6
C5H6O 2-methylfuran 1.348 1 2
    1.347 1 3
C5H6O Pentadienal 1.191 1 2
C5H6O 3-Methylfuran 1.348 1 2
    1.341 1 3
C4H7NO Methacrylamide 4.105 3 5
C3H7ONO Propyl nitrite 1.426 3 4
C4H7NO Ethoxyacetonitrile 1.405 2 3
    1.383 3 4
NH(CH3)CONH(CH3) Urea, N,N'-dimethyl- 1.201 1 2
C5H8O Cyclopentanone 1.189 1 2
C4H8O2 Ethyl acetate 1.326 2 3
    1.188 2 4
    1.424 3 5
C5H8O Methyl cyclopropyl ketone 1.196 1 2
C4H8O2 Butanoic acid 1.333 1 5
    1.188 1 6
C5H10O 2-methylbutyraldehyde 1.188 1 6
C5H10O 3-Pentanone 1.193 1 2
CF3COF trifluoroacetyl fluoride 1.160 2 3
CF3COO- trifluoro acetate anion 1.218 2 6
    1.221 2 7
C4H2O3 Maleic Anhydride 1.172 2 4
    1.172 3 5
    1.360 1 2
    1.360 1 3
C5H4O2 4-Cyclopentene-1,3-dione 1.187 2 6
    1.187 3 7
C5H4O2 furfural 1.191 6 7
    1.334 1 2
    1.352 1 4
C6H6O 2,5-Cyclohexadienone 1.199 1 7
HO2CCHNH2CH2OH Serine 1.328 1 2
    1.192 1 3
    1.394 5 6
C5H8O2 Acetylacetone 1.192 2 6
    1.192 3 7
C6H12O Oxepane 1.399 1 2
    1.401 1 7
C3H7OC3H7 di-n-propyl ether 1.397 1 2
    1.397 1 3
C6H4O2 parabenzoquinone 1.194 1 7
    1.194 2 8
C6H5CHO benzaldehyde 1.191 7 8
C5H9NO2 Proline 1.188 6 7
    1.333 6 8
C6H12O2 Hexanoic acid 1.333 6 7
    1.188 6 8
C6H12O2 Methyl pivalate 1.328 3 6
    1.189 3 7
    1.416 6 8
C3H3N3O3 cyanuric acid 1.186 1 7
    1.186 2 8
    1.186 3 9
CH3COC6H5 acetophenone 1.195 2 4
C8H18O 1-Octanol 1.404 8 9
C6H12O6 Inositol 1.391 1 7
    1.391 2 8
    1.391 3 9
    1.391 4 10
    1.391 5 11
    1.391 6 12