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Compare Calculated Bonds for H-O

17 01 10 14 40

CCSD/aug-cc-pVQZ

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


Values greater than 2.00 are in the 2.00 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
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
0.994 0.140

  Species Name Bond Length (Å)
Lowest value LiOH lithium hydroxide 0.946
Highest value O3H+ protonated ozone 1.849

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
OH- hydroxide anion 0.961 1 2
OH Hydroxyl radical 0.968 1 2
OH+ hydoxyl cation 1.026 1 2
H2O- water anion 0.963 1 2
    0.963 1 3
H2O Water 0.956 1 2
    0.956 1 3
H2O+ water cation 0.997 1 2
    0.997 1 3
HDO Water-d1 0.956 1 2
    0.956 1 3
H3O+ hydronium cation 0.974 1 2
    0.974 1 3
    0.974 1 4
LiOH lithium hydroxide 0.946 1 3
HO2 Hydroperoxy radical 0.968 1 3
HO2+ Hydroperoxy cation 1.007 1 3
BeOH beryllium monohydroxide 0.947 1 3
NOH Hydroxyimidogen 0.966 2 3
NOH+ O-protonated nitric oxide 1.012 2 3
COH+ Carbon Monoxide, protonated 0.987 2 3
SOH+ Sulfur Monoxide, protonated 0.978 2 3
HOF Hypofluorous acid 0.964 1 2
HOCl hypochlorous acid 0.961 1 2
HOCl+ hypochlorous acid cation 0.985 1 2
HOBr Hypobromous acid 0.961 1 2
HOBr+ Hypobromous acid cation 0.979 1 2
H2O2 Hydrogen peroxide 0.960 1 3
    0.960 2 4
H2O2+ Hydrogen peroxide cation 0.989 1 3
    0.989 2 4
HOCH hydroxycarbene 0.962 2 4
HOSH hydrogen thioperoxide 0.958 2 4
CH2OH+ hydroxymethyl cation 0.976 2 5
NH2OH hydroxylamine 0.956 2 3
H2POH Phosphinous acid 0.955 2 3
CH3OH+ Methyl alcohol cation 0.983 2 6
O3H+ protonated ozone 1.849 2 4
HCOOH Formic acid 0.964 2 5