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Compare Calculated Bonds for C-O

17 01 10 14 40

AM1

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


Values greater than 1.55 are in the 1.55 bin. Values less than 1.10 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
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.333 0.091

  Species Name Bond Length (Å)
Lowest value HCO+ Formyl cation 1.146
Highest value C3H6O Oxetane 1.458

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
HCO Formyl radical 1.192 1 3
HCO+ Formyl cation 1.146 1 3
H2CO- formaldehyde anion 1.281 1 2
HOCH hydroxycarbene 1.279 1 2
CH3OH- Methyl alcohol anion 1.354 1 2
CH3OH+ Methyl alcohol cation 1.352 1 2
HCCO ketenyl radical 1.209 1 3
HCOOH Formic acid 1.366 1 2
    1.227 1 3
C2H2O Oxirene 1.457 1 2
    1.457 1 3
CHONH2 formamide 1.243 1 2
BH3CO Borane carbonyl 1.175 2 3
CH2FOH fluoromethanol 1.405 1 3
C2H4O Ethylene oxide 1.436 1 2
    1.436 1 3
NH2CHOH+ Formamide, O-protonated 1.330 1 2
CH3OCH3 Dimethyl ether 1.417 1 2
    1.417 1 3
CF2O Carbonic difluoride 1.220 1 2
CF2O+ Carbonic difluoride cation 1.307 1 2
HCO3- bicarbonate anion 1.400 1 2
    1.251 1 4
    1.259 1 5
C2H2O2 Ethanedial 1.228 1 5
    1.228 2 6
C3H2O Propadienal 1.195 3 4
NH2COOH Carbamic acid 1.245 1 2
    1.377 1 4
CH3NCO methylisocyante 1.202 3 4
CH2CHCHO Acrolein 1.233 1 4
CH3C(OH)=NH Ethaninidic acid 1.382 1 4
CH2FCH2OH 2-fluoroethanol 1.411 1 3
CH3COCH3- acetone anion 1.287 1 2
C3H6O Oxetane 1.458 1 3
    1.458 1 4
C3H7OH 1-Propanol 1.420 3 4
CHOOCHO diformyl ether 1.222 2 4
    1.222 3 5
    1.384 1 2
    1.384 1 3
CHCl2CHO dichloroacetaldehyde 1.226 2 6
C3H3NO Isoxazole 1.411 3 5
HOCH2COOH Hydroxyacetic acid 1.407 1 5
    1.358 2 3
    1.234 2 4
C4H4O Furan 1.395 1 2
    1.395 1 3
CH3OCH2CN Methoxyacetonitrile 1.420 1 2
    1.417 2 3
C3H8O2 1,3-Propanediol 1.420 2 6
    1.412 3 7
C3H2O3 vinylene carbonate 1.212 1 2
    1.385 1 3
    1.385 1 4
    1.411 3 5
    1.411 4 6
C4H6O2 γ–Butyrolactone 1.382 1 5
    1.224 1 6
    1.441 4 5
C3H6O3 1,3,5-Trioxane 1.415 1 4
    1.415 1 5
    1.415 2 4
    1.415 2 6
    1.415 3 5
    1.415 3 6
C4H6O2 2,3-Butanedione 1.233 1 5
    1.233 2 6
C4H8O2 Ethyl acetate 1.367 2 3
    1.233 2 4
    1.439 3 5
C5H10O 3-Pentanone 1.234 1 2
C5H8O2 Acetylacetone 1.234 2 6
    1.234 3 7
C6H12O Oxepane 1.420 1 2
    1.422 1 7
C6H5CHO benzaldehyde 1.233 7 8
C6H12O2 Hexanoic acid 1.365 6 7
    1.234 6 8