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Compare Calculated Bonds for O-H

17 01 10 14 40

PBEPBE/6-311+G(3df,2p)

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


Values greater than 4.50 are in the 4.50 bin. Values less than 0.50 are in the 0.50 bin.

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histogram chart 0 line line line line histogram chart line line line line line histogram chart line line histogram chart line line line line line line line line histogram chart line line line line
0.50 1.00 1.50 2.00 2.50 3.00 3.50 4.00 4.50
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.113 0.436

  Species Name Bond Length (Å)
Lowest value LiOH lithium hydroxide 0.958
Highest value C3H7OH 1-Propanol 3.769

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
OH Hydroxyl radical 0.983 1 2
OH+ hydoxyl cation 1.046 1 2
H2O- water anion 1.050 1 2
    1.050 1 3
H2O Water 0.969 1 2
    0.969 1 3
H2O+ water cation 1.013 1 2
    1.013 1 3
HDO Water-d1 0.969 1 2
    0.969 1 3
LiOH lithium hydroxide 0.958 1 3
HO2 Hydroperoxy radical 0.986 1 3
BeOH beryllium monohydroxide 0.959 1 3
COH Hydroxymethylidyne 1.004 2 3
MgOH magnesium hydroxide 0.962 1 3
SOH Sulfur Hydroxide 0.976 2 3
SOH+ Sulfur Monoxide, protonated 0.993 2 3
KOH Potassium hydroxide 0.964 2 3
HOF Hypofluorous acid 0.980 1 2
HOCl hypochlorous acid 0.976 1 2
HOCl+ hypochlorous acid cation 1.001 1 2
HOBr Hypobromous acid 0.975 1 2
H2O2 Hydrogen peroxide 0.975 1 3
    0.975 2 4
H2OO water oxide 0.979 1 3
    0.979 1 4
HOSH hydrogen thioperoxide 0.973 2 4
CH2OH Hydroxymethyl radical 0.970 2 5
CH2OH+ hydroxymethyl cation 0.991 2 5
NH2OH hydroxylamine 0.970 2 3
NH2OH+ Hydroxylamine cation 0.990 2 3
CH3OH+ Methyl alcohol cation 0.992 2 6
NH3OH+ N-protonated hydroxylamine 0.982 2 3
NH2OH2+ protonated hydroxylamine 0.986 2 5
    0.988 2 6
SiH3OH silanol 0.966 2 6
H5O2+ Dihydroxonium ion 1.209 1 2
    1.209 1 3
    0.975 2 4
    0.976 2 5
    0.975 3 6
    0.976 3 7
HOCO Hydrocarboxyl radical 0.974 2 4
O3H+ protonated ozone 1.930 2 4
HCOOH Formic acid 0.979 2 5
Be(OH)2 Beryllium hydroxide 0.960 2 4
    0.960 3 5
H2COO Dioxymethyl radical 2.043 1 3
    1.991 1 4
H2COO+ dioxymethyl cation 2.057 1 3
    1.972 1 4
HOCHNH hydroxymethylimine 0.970 2 5
CH2COH+ ketene, protonated 0.995 3 6
CH2FOH fluoromethanol 0.971 3 6
NH2CHOH+ Formamide, O-protonated 0.981 2 7
NH2CH2OH aminomethanol 0.970 3 8
C2H4OH+ ethylene oxide, protonated 0.985 1 2
CH3CH2OH Ethanol 0.969 3 4
HNO3 Nitric acid 0.980 2 5
HClO3 Chloric Acid 2.484 2 5
HOCH2CN cyanomethanol 0.971 3 6
H3AlO3 Aluminum hydroxide 0.965 2 5
    0.965 3 6
    0.965 4 7
CH3COOH Acetic acid 0.978 7 8
CH3C(OH)=NH Ethaninidic acid 0.977 4 9
CH2C(OH)NH2 1-amino vinyl alchohol 0.970 4 9
CH2FCH2OH 2-fluoroethanol 0.971 3 9
C3H6O Acetone enol 0.972 4 10
CH3CHOHCH3 Isopropyl alcohol 0.970 4 12
C3H7OH 1-Propanol 3.769 4 12
H2SO4 Sulfuric acid 0.977 5 6
    0.977 4 7
C4H10O Ethanol, 1,1-dimethyl- 0.971 14 15