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Compare Calculated Bonds for O-H

17 01 10 14 40

BLYP/daug-cc-pVTZ

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


Values greater than 2.10 are in the 2.10 bin. Values less than 0.90 are in the 0.90 bin.

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0.90 1.00 1.10 1.20 1.30 1.40 1.50 1.60 1.70 1.80 1.90 2.00 2.10
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.007 0.160

  Species Name Bond Length (Å)
Lowest value BeOH beryllium monohydroxide 0.961
Highest value O3H+ protonated ozone 1.964

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
OH- hydroxide anion 0.976 1 2
OH Hydroxyl radical 0.986 1 2
OH+ hydoxyl cation 1.052 1 2
H2O- water anion 0.978 1 2
    0.978 1 3
H2O Water 0.972 1 2
    0.972 1 3
BeOH beryllium monohydroxide 0.961 1 3
SOH+ Sulfur Monoxide, protonated 0.996 2 3
HOF Hypofluorous acid 0.983 1 2
HOCl hypochlorous acid 0.979 1 2
HOCl+ hypochlorous acid cation 1.004 1 2
H2O2 Hydrogen peroxide 0.978 1 3
    0.978 2 4
H2OO water oxide 0.980 1 3
    0.980 1 4
HOSH hydrogen thioperoxide 0.975 2 4
NH2OH hydroxylamine 0.973 2 3
NH2OH+ Hydroxylamine cation 0.993 2 3
CH3OH+ Methyl alcohol cation 0.995 2 6
NH3OH+ N-protonated hydroxylamine 0.985 2 3
NH2OH2+ protonated hydroxylamine 0.988 2 5
    0.990 2 6
SiH3OH silanol 0.968 2 6
HOCO Hydrocarboxyl radical 0.976 2 4
O3H+ protonated ozone 1.964 2 4
HCOOH Formic acid 0.981 2 5
CH2FOH fluoromethanol 0.974 3 6
NH2CHOH+ Formamide, O-protonated 0.984 2 7
CH3CH2OH Ethanol 0.971 3 4
HNO3 Nitric acid 0.982 2 5
H3AlO3 Aluminum hydroxide 0.967 2 5
    0.967 3 6
    0.967 4 7
CH3C(OH)=NH Ethaninidic acid 0.979 4 9
CH2FCH2OH 2-fluoroethanol 0.973 3 9
C3H7OH 1-Propanol 0.971 4 12