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Compare Calculated Bonds for B-B

17 01 10 14 40

B97D3/3-21G

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


Values greater than 2.00 are in the 2.00 bin. Values less than 1.10 are in the 1.10 bin.

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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
1.633 0.156

  Species Name Bond Length (Å)
Lowest value B5H9 pentaborane9 1.185
Highest value B5H9 pentaborane9 1.820

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
B2- Boron diatomic anion 1.670 1 2
B2 Boron diatomic 1.459 1 2
B2+ Boron diatomic cation 1.539 1 2
HBBH Diborane(2) 1.528 1 2
HBHHBH Diborane(4) C2V 1.473 1 2
B2H4 Diborane(4) D2d 1.640 1 2
B2H6+ Diborane cation 1.630 1 2
B2O2 Diboron dioxide 1.546 1 2
B5H9 pentaborane9 1.185 1 2
    1.711 1 3
    1.711 1 4
    1.820 3 4
    1.711 1 5
    1.820 4 5
    1.711 1 6
    1.820 3 6
    1.820 5 6
B2F4 Diboron tetrafluoride 1.702 1 2
B2Cl4 Diboron tetrachloride 1.533 1 2