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Information card for entry 7230129
Preview
Coordinates | 7230129.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C62 H68 Cl2 N8 O4 Pb |
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Calculated formula | C62 H68 Cl2 N8 O4 Pb |
SMILES | [Pb]1(Cl)(Cl)[n]2ccc(cc2)CN2CCCN(Cc3c(OCCOc4c(C2)cccc4)cccc3)Cc2cc[n](cc2)[Pb](Cl)(Cl)([n]2ccc(cc2)CN2CCCN(Cc3c(OCCOc4c(C2)cccc4)cccc3)Cc2cc[n]1cc2)([n]1ccc(cc1)CN1CCCN(Cc2c(OCCOc3c(C1)cccc3)cccc2)Cc1ccncc1)[n]1ccc(cc1)CN1CCCN(Cc2c(OCCOc3c(C1)cccc3)cccc2)Cc1ccncc1 |
Title of publication | Synthesis, X-ray crystallography, thermogravimetric analysis and spectroscopic characterization of isostructural one-dimensional coordination polymers as sorbents for some anions |
Authors of publication | Ghanbari, Bahram; Shahhoseini, Leila; Owczarzak, Agata; Kubicki, Maciej; Kia, Reza; Raithby, Paul R. |
Journal of publication | CrystEngComm |
Year of publication | 2018 |
Journal volume | 20 |
Journal issue | 13 |
Pages of publication | 1783 |
a | 8.69 ± 0.0002 Å |
b | 23.6505 ± 0.0004 Å |
c | 13.7975 ± 0.0003 Å |
α | 90° |
β | 92.038 ± 0.002° |
γ | 90° |
Cell volume | 2833.91 ± 0.1 Å3 |
Cell temperature | 100 ± 1 K |
Ambient diffraction temperature | 100 ± 1 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.05 |
Residual factor for significantly intense reflections | 0.029 |
Weighted residual factors for significantly intense reflections | 0.0481 |
Weighted residual factors for all reflections included in the refinement | 0.0522 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
Diffraction radiation probe | x-ray |
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/7230129.html
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structural data.