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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 O-F
17 01 10 14 40
B2PLYP=FULLultrafine/6-31G(2df,p)
Histogram of Bond lengths (in Å) vs number of species
Values greater than 1.46 are in the 1.46 bin.
Values less than 1.34 are in the 1.34 bin.
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1.34 |
1.35 |
1.36 |
1.37 |
1.38 |
1.39 |
1.40 |
1.41 |
1.42 |
1.43 |
1.44 |
1.45 |
1.46 |
bond lengths (Å) |
Summary: (Å)
Average bond length |
Standard deviation |
1.412 |
0.038 |
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Species |
Name |
Bond Length (Å) |
Lowest value |
FO |
Oxygen monofluoride |
1.340 |
Highest value |
FOO+ |
Fluorine dioxide cation |
1.453 |
Calculated Bond lengths
Click on entry for all calculated results.