Information card for entry 7052173

Structure parameters

• Formula: C33 H24 N2 Pt
• Calculated formula: C33 H24 N2 Pt
• SMILES: [Pt]12(c3c(c4[n]1c(c1[n]2cccc1)ccc4)cccc3)C#Cc1cc2C(c3c(c2cc1)cccc3)(C)C
• Title of publication: Design and preparation of neutral substituted fluorene- and carbazole-based platinum(ii)‒acetylide complexes
• Authors of publication: Seneclauze, Julie Batcha; Retailleau, Pascal; Ziessel, Raymond
• Journal of publication: New Journal of Chemistry
• Year of publication: 2007
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 1412
• a: 7.2707 ± 0.0006 Å
• b: 12.3313 ± 0.001 Å
• c: 28.699 ± 0.002 Å
• α: 90°
• β: 96.684 ± 0.002°
• γ: 90°
• Cell volume: 2555.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0423
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.1001
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.581
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No