Information card for entry 7118957

Structure parameters

• Formula: C76 H68 Cl8 Fe2 N4 O4 P4 Pt
• Calculated formula: C76 H68 Cl8 Fe2 N4 O4 P4 Pt
• Title of publication: Tetrahedral cage complex with planar vertices: selective synthesis of Pt4L6 cage complexes involving hydrogen bonds driven by halide binding
• Authors of publication: Masaki Ito; Masato Iseki; Masumi Itazaki; Hiroshi Nakazawa
• Journal of publication: Chem.Commun.
• Year of publication: 2016
• Journal volume: 52
• Pages of publication: 7205
• a: 29.1376 ± 0.0018 Å
• b: 15.0037 ± 0.0008 Å
• c: 18.0317 ± 0.0012 Å
• α: 90°
• β: 109.95 ± 0.002°
• γ: 90°
• Cell volume: 7409.9 ± 0.8 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0494
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0883
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No