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Information card for entry 4088087
Preview
| Coordinates | 4088087.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C20 H30 Pb |
|---|---|
| Calculated formula | C20 H30 Pb |
| SMILES | [Pb]12345678([c]9([c]1([c]2([c]3([c]49C)C)C)C)C)[c]1([c]5([c]6([c]7([c]81C)C)C)C)C |
| Title of publication | Ln(II)/Pb(II)–Ln(III)/Pb(0) Redox Approach toward Rare-Earth-Metal Half-Sandwich Complexes |
| Authors of publication | Bienfait, André M.; Wolf, Benjamin M.; Törnroos, Karl W.; Anwander, Reiner |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 24 |
| Pages of publication | 5734 |
| a | 9.7235 ± 0.0003 Å |
| b | 13.6123 ± 0.0004 Å |
| c | 14.373 ± 0.0005 Å |
| α | 90° |
| β | 93.79° |
| γ | 90° |
| Cell volume | 1898.24 ± 0.1 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 3 |
| 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 | 0.0135 |
| Residual factor for significantly intense reflections | 0.0123 |
| Weighted residual factors for significantly intense reflections | 0.0311 |
| Weighted residual factors for all reflections included in the refinement | 0.0315 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301831 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/08/ Each referenced PubChem compound corresponds to the full crystal structure. |
4088087.cif |
| 237248 | 2019-11-24 | cif/ Adding structures of 4088073, 4088074, 4088075, 4088076, 4088077, 4088078, 4088079, 4088080, 4088081, 4088082, 4088083, 4088084, 4088085, 4088086, 4088087 via cif-deposit CGI script. |
4088087.cif |
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Users of the data should acknowledge the original authors of the
structural data.