Information card for entry 4331548

Structure parameters

• Formula: C70 H66 B2 F8 N2 P4 Pt2
• Calculated formula: C70 H66 B2 F8 N2 P4 Pt2
• SMILES: [Pt]12([Pt]([P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([P](C[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)C#[N]c1ccc(cc1)C(C)C)C#[N]c1ccc(cc1)C(C)C.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-]
• Title of publication: Solution and Solid-State Properties of Luminescent M−M Bond-Containing Coordination/Organometallic Polymers Using the RNC-M2(dppm)2-CNR Building Blocks (M = Pd, Pt; R = Aryl, Alkyl)
• Authors of publication: Bérubé, Jean-François; Gagnon, Karl; Fortin, Daniel; Decken, Andreas; Harvey, Pierre D.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 7
• Pages of publication: 2812 - 2823
• a: 21.9667 ± 0.0012 Å
• b: 16.5006 ± 0.0009 Å
• c: 36.265 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13144.7 ± 1.2 ų
• Cell temperature: 198 ± 1 K
• Ambient diffraction temperature: 198 ± 1 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0334
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.065
• Weighted residual factors for all reflections included in the refinement: 0.0682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No