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Information card for entry 4311998
Preview
| Coordinates | 4311998.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [Ar#PbBr]2.2toluene |
|---|---|
| Formula | C90 H122 Br2 Pb2 |
| Calculated formula | C90 H122 Br2 Pb2 |
| SMILES | [Pb]1([Br][Pb]([Br]1)c1c(cccc1c1c(cc(cc1C(C)C)C(C)(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)(C)C)C(C)C)c1c(cccc1c1c(cc(cc1C(C)C)C(C)(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)(C)C)C(C)C.c1(ccccc1)C.c1(ccccc1)C |
| Title of publication | Terphenyl Ligand Stabilized Lead(II) Derivatives: Steric Effects and Lead-Lead Bonding in Diplumbenes |
| Authors of publication | Shirley Hino; Marilyn Olmstead; Andrew D. Phillips; Robert J. Wright; Philip P. Power |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2004 |
| Journal volume | 43 |
| Pages of publication | 7346 - 7352 |
| a | 14.23 ± 0.002 Å |
| b | 14.791 ± 0.003 Å |
| c | 20.433 ± 0.004 Å |
| α | 100.245 ± 0.007° |
| β | 94.306 ± 0.006° |
| γ | 97.848 ± 0.007° |
| Cell volume | 4170.6 ± 1.3 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0651 |
| Residual factor for significantly intense reflections | 0.0343 |
| Weighted residual factors for significantly intense reflections | 0.0747 |
| Weighted residual factors for all reflections included in the refinement | 0.0869 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179158 (current) | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/19. |
4311998.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4311998.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4311998.cif |
| 3500 | 2010-11-16 | ../uploads/cif-deposit/cod/cif Adding structures of 4311998 via cif-deposit CGI script. |
4311998.cif |
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