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Compare Calculated Bonds for O-H

17 01 10 14 40

QCISD(TQ)=FULL/6-31G*

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
1.141 0.363

  Species Name Bond Length (Å)
Lowest value BeOH beryllium monohydroxide 0.953
Highest value H2COO+ dioxymethyl cation 2.055

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
OH- hydroxide anion 0.989 1 2
H2O Water 0.971 1 2
    0.971 1 3
H3O+ hydronium cation 0.991 1 2
    0.991 1 3
    0.991 1 4
LiOH lithium hydroxide 0.962 1 3
HO2 Hydroperoxy radical 0.986 1 3
HO2+ Hydroperoxy cation 1.026 1 3
BeOH beryllium monohydroxide 0.953 1 3
NOH Hydroxyimidogen 0.983 2 3
NOH+ O-protonated nitric oxide 1.032 2 3
COH+ Carbon Monoxide, protonated 1.003 2 3
SOH+ Sulfur Monoxide, protonated 0.995 2 3
HOCl+ hypochlorous acid cation 1.003 1 2
H2O2 Hydrogen peroxide 0.977 1 3
    0.977 2 4
CH2OH Hydroxymethyl radical 0.973 2 5
NH2OH hydroxylamine 0.973 2 3
NH2OH+ Hydroxylamine cation 0.992 2 3
CH3OH- Methyl alcohol anion 1.828 2 6
H2OH2O water dimer 0.976 1 2
    1.978 1 3
    0.970 2 4
    0.973 3 5
    0.973 3 6
O3H+ protonated ozone 1.010 2 4
NNOH+ Nitrous Oxide, O-protonated 1.002 3 4
HCOOH Formic acid 0.981 2 5
Be(OH)2 Beryllium hydroxide 0.963 2 4
    0.963 3 5
H2COO Dioxymethyl radical 2.034 1 3
    1.991 1 4
H2COO+ dioxymethyl cation 2.055 1 3
    1.968 1 4
CH2BOH hydroxy(methylene)borane 0.974 3 6
NH2COOH2+ Carbamic acid, O-protonated 0.981 2 8
    0.984 4 7