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Computational Chemistry Comparison and Benchmark DataBase
Release 22 (May 2022) Standard Reference Database 101
National Institute of Standards and Technology
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You are here: Calculated > Geometry > Calculated geometry > One type of bond
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Compare Calculated Bonds for F-Ga
17 01 10 14 40
B2PLYP=FULLultrafine/6-31G(2df,p)
Histogram of Bond lengths (in Å) vs number of species
Values greater than 1.79 are in the 1.79 bin.
Values less than 1.71 are in the 1.71 bin.
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1.71 |
1.72 |
1.73 |
1.74 |
1.75 |
1.76 |
1.77 |
1.78 |
1.79 |
bond lengths (Å) |
Summary: (Å)
Average bond length |
Standard deviation |
1.735 |
0.021 |
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Species |
Name |
Bond Length (Å) |
Lowest value |
GaF+ |
Gallium monofluoride cation |
1.712 |
Highest value |
GaF |
Gallium monofluoride |
1.775 |
Calculated Bond lengths
Click on entry for all calculated results.