Information card for entry 4345916

Structure parameters

• Formula: C64 H50 Ag2 N6 P2 Pt2
• Calculated formula: C64 H50 Ag2 N6 P2 Pt2
• SMILES: C(#N)[Pt]12C#[N][Ag]([P](c3ccccc3)(c3ccccc3)c3ccccc3)[c]34cc(ccc3c3[n](cccc3)[Pt]4(C#N)C#[N][Ag]([c]31cc(C)ccc3c1[n]2cccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1)C
• Title of publication: Cyclometalated Platinum(II) Cyanometallates: Luminescent Blocks for Coordination Self-Assembly.
• Authors of publication: Schneider, Leon; Sivchik, Vasily; Chung, Kun-You; Chen, Yi-Ting; Karttunen, Antti J.; Chou, Pi-Tai; Koshevoy, Igor O.
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• a: 9.802 ± 0.0002 Å
• b: 14.8584 ± 0.0004 Å
• c: 19.2882 ± 0.0005 Å
• α: 90°
• β: 104.034 ± 0.001°
• γ: 90°
• Cell volume: 2725.32 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• 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: 0.0309
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.0432
• Weighted residual factors for all reflections included in the refinement: 0.0456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No