Information card for entry 7705596

Structure parameters

• Formula: C48 H34 Cl6 N4 Pt
• Calculated formula: C48 H34 Cl6 N4 Pt
• SMILES: [Pt](Cl)(Cl)(Cl)(Cl)([Cl-])[Cl-].n1c(c2ccccc2)ccc2ccc3c([nH+]c(cc3)c3ccccc3)c12.[nH+]1c(c2ccccc2)ccc2ccc3c(nc(cc3)c3ccccc3)c12
• Title of publication: Protonation-induced self-assembly of bis-phenanthroline macrocycles into nanofibers arrayed with tetrachloroaurate, hexachloroplatinate or phosphomolybdate ions.
• Authors of publication: Tashiro, Shohei; Shimizu, Shun; Kuritani, Masumi; Shionoya, Mitsuhiko
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 40
• Pages of publication: 13948 - 13953
• a: 12.2029 ± 0.0002 Å
• b: 13.3559 ± 0.0002 Å
• c: 13.8683 ± 0.0002 Å
• α: 80.7745 ± 0.0014°
• β: 67.0066 ± 0.0017°
• γ: 80.4839 ± 0.0016°
• Cell volume: 2040.61 ± 0.06 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0326
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0527
• Weighted residual factors for all reflections included in the refinement: 0.0544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No