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Information card for entry 2021090
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Coordinates | 2021090.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[[triphenyllead(IV)]-μ-chlorido-[triphenyllead(IV)]-μ-dimethylarsinato-κ^2^<i>O</i>:<i>O</i>'] |
---|---|
Formula | C38 H36 As Cl O2 Pb2 |
Calculated formula | C38 H36 As Cl O2 Pb2 |
SMILES | [Pb](c1ccccc1)(c1ccccc1)(c1ccccc1)[O]=[As](C)(C)O[Pb](c1ccccc1)(c1ccccc1)(c1ccccc1)[Cl][Pb](c1ccccc1)(c1ccccc1)(c1ccccc1)[O]=[As](C)(C)O[Pb](c1ccccc1)(c1ccccc1)(c1ccccc1)Cl |
Title of publication | Between MOFs and molecules: organolead(IV) compounds with chain structures |
Authors of publication | Shihada, Abdel-Fattah; Weller, Frank; Massa, Werner |
Journal of publication | Acta Crystallographica Section C Structural Chemistry |
Year of publication | 2018 |
Journal volume | 74 |
Journal issue | 5 |
a | 19.0566 ± 0.0008 Å |
b | 15.5255 ± 0.001 Å |
c | 24.0975 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7129.6 ± 0.7 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 6 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0635 |
Residual factor for significantly intense reflections | 0.0398 |
Weighted residual factors for significantly intense reflections | 0.0741 |
Weighted residual factors for all reflections included in the refinement | 0.079 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2021090.html
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Users of the data should acknowledge the original authors of the
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