Information card for entry 4321939

Structure parameters

• Formula: C44 H50 N2 Pt Se2 Sn2
• Calculated formula: C44 H50 N2 Pt Se2 Sn2
• SMILES: [Pt]12([Sn]([Se][Sn]([Se]1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([n]1ccc(C(C)(C)C)cc1c1[n]2ccc(c1)C(C)(C)C)(C)C
• Title of publication: Synthesis of Metallacycles by Oxidative Addition of Sn-S, Sn-Se, Sn-Te, and Ge-Te Containing Precursors to Platinum(II)
• Authors of publication: Michael C. Janzen; Hilary A. Jenkins; Louis M. Rendina; Jagadese J. Vittal; Richard J. Puddephatt
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 2123 - 2130
• a: 12.3717 ± 0.0014 Å
• b: 16.702 ± 0.002 Å
• c: 21.113 ± 0.007 Å
• α: 90°
• β: 92.26 ± 0.02°
• γ: 90°
• Cell volume: 4359.2 ± 1.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0887
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for all reflections: 0.1221
• Weighted residual factors for significantly intense reflections: 0.1036
• Goodness-of-fit parameter for all reflections: 1.065
• Goodness-of-fit parameter for significantly intense reflections: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No