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Information card for entry 7212835
Preview
Coordinates | 7212835.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H18 N8 |
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Calculated formula | C22 H18 N8 |
SMILES | n1ccccc1c1nnn(c1)Cc1cc(Cn2nnc(c2)c2ncccc2)ccc1 |
Title of publication | Lead(ii) complexes of bis- and tris-bidentate compartmental ligands based on pyridyl-pyrazole and pyridyl-triazole fragments: coordination networks and a discrete dimeric box |
Authors of publication | Najar, Adel M.; Tidmarsh, Ian S.; Ward, Michael D. |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 11 |
Pages of publication | 3642 |
a | 9.817 ± 0.0005 Å |
b | 9.9754 ± 0.0005 Å |
c | 38.6879 ± 0.0017 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3788.6 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 3 |
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 | 0.0558 |
Residual factor for significantly intense reflections | 0.0407 |
Weighted residual factors for significantly intense reflections | 0.0934 |
Weighted residual factors for all reflections included in the refinement | 0.1008 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
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/7212835.html
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Users of the data should acknowledge the original authors of the
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