Information card for entry 7000863

Structure parameters

• Formula: C41 H43.5 Cl2 N10 O7.75 Pt2 S
• Calculated formula: C41 H32 Cl2 N10 O7.75 Pt2 S
• Title of publication: Effect of metal coordination on the interaction of substituted phenanthroline and pyridine ligands with quadruplex DNA
• Authors of publication: Reed, Julie E.; White, Andrew J. P.; Neidle, Stephen; Vilar, Ramón
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 14
• Pages of publication: 2558 - 2568
• a: 17.3137 ± 0.0015 Å
• b: 11.0617 ± 0.0007 Å
• c: 24.561 ± 0.002 Å
• α: 90°
• β: 104.763 ± 0.003°
• γ: 90°
• Cell volume: 4548.6 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• 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: 0.156
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections included in the refinement: 0.1358
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No