Information card for entry 1515952

Structure parameters

• Formula: C14 H15 Cl N2 O Pt
• Calculated formula: C14 H15 Cl N2 O Pt
• SMILES: [Pt]1(c2c(c3[n]1cccc3)cccc2)(Cl)[O]=CN(C)C
• Title of publication: Synthesis, crystal structure, solution and spectroscopic properties, and hydrogen-evolving activity of [K(18-crown-6)][Pt(ii)(2-phenylpyridinato)Cl2]
• Authors of publication: Kobayashi, Masayuki; Masaoka, Shigeyuki; Sakai, Ken
• Journal of publication: Photochemical & Photobiological Sciences
• Year of publication: 2009
• Journal volume: 8
• Journal issue: 2
• Pages of publication: 196
• a: 8.6659 ± 0.0012 Å
• b: 8.0222 ± 0.0011 Å
• c: 39.984 ± 0.005 Å
• α: 90°
• β: 91.551 ± 0.002°
• γ: 90°
• Cell volume: 2778.7 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No