Information card for entry 4080691

Structure parameters

• Formula: C39 H48 Cl0 N2 P2 Pb2 S2
• Calculated formula: C39 H48 N2 P2 Pb2 S2
• SMILES: [Pb]123[S]=P(C42[Pb]2([n]5c6ccccc6ccc45)[n]4c5ccccc5ccc4C32P(=[S]1)(C(C)C)C(C)C)(C(C)C)C(C)C.Cc1ccccc1
• Title of publication: Synthesis and Structural Characterization of Lithium, Potassium, Magnesium, and Heavier Group 14 Metal Complexes Derived from 2-Quinolyl-Linked (Thiophosphorano)methane
• Authors of publication: Leung, Wing-Por; Chan, Yuk-Chi; Mak, Thomas C. W.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 9
• Pages of publication: 2584
• a: 11.2271 ± 0.0007 Å
• b: 13.4898 ± 0.0008 Å
• c: 15.2475 ± 0.0009 Å
• α: 100.943 ± 0.001°
• β: 108.536 ± 0.001°
• γ: 105.108 ± 0.001°
• Cell volume: 2017.8 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.1441
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No