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Information card for entry 2231903
Preview
Coordinates | 2231903.cif |
---|---|
Structure factors | 2231903.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(μ-azido-κ^2^<i>N</i>^1^:<i>N</i>^1^)bis{(acetato- κ^2^<i>O</i>,<i>O</i>')[2,4,6-tris(2-pyridyl)-1,3,5-triazine- κ^3^<i>N</i>^2^,<i>N</i>^1^,<i>N</i>^6^]lead(II)} |
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Formula | C40 H30 N18 O4 Pb2 |
Calculated formula | C40 H30 N18 O4 Pb2 |
SMILES | [Pb]1234([O]=C(O1)C)([n]1ccccc1c1nc(nc([n]21)c1[n]3cccc1)c1ncccc1)[N](=N#N)[Pb]123([O]=C(O1)C)([n]1ccccc1c1nc(nc([n]21)c1[n]3cccc1)c1ncccc1)[N]4=N#N |
Title of publication | Bis(μ-azido-κ^2^<i>N</i>^1^:<i>N</i>^1^)bis{(acetato-κ^2^<i>O</i>,<i>O</i>')[2,4,6-tris(2-pyridyl)-1,3,5-triazine-κ^3^<i>N</i>^2^,<i>N</i>^1^,<i>N</i>^6^]lead(II)} |
Authors of publication | Dayani, Milad; Ghaemi, Akbar; Ng, Seik Weng; Tiekink, Edward R. T. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 10 |
Pages of publication | m1419 |
a | 8.5529 ± 0.0004 Å |
b | 11.008 ± 0.0005 Å |
c | 11.8617 ± 0.0005 Å |
α | 86.739 ± 0.004° |
β | 70.928 ± 0.004° |
γ | 70.1 ± 0.004° |
Cell volume | 990.6 ± 0.09 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0351 |
Residual factor for significantly intense reflections | 0.0242 |
Weighted residual factors for significantly intense reflections | 0.0466 |
Weighted residual factors for all reflections included in the refinement | 0.0492 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.969 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2231903.html
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