Information card for entry 2009155

Structure parameters

• Formula: C14 H20 Cl2 N4 O2 Pt
• Calculated formula: C14 H20 Cl2 N4 O2 Pt
• SMILES: C1[NH2][Pt]2([n]3cccc4ccc5c([n]2ccc5)c34)[NH2]C1.O.O.[Cl-].[Cl-]
• Title of publication: Anion-controlled π-stacks of (ethylenediamine-<i>N</i>,<i>N</i>')(1,10-phenanthroline-<i>N</i>,<i>N</i>')platinum(II)
• Authors of publication: Kato, Masako; Takahashi, Junko
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 11
• Pages of publication: 1809 - 1812
• a: 7.357 ± 0.002 Å
• b: 15.528 ± 0.002 Å
• c: 15.137 ± 0.002 Å
• α: 90°
• β: 94.68 ± 0.02°
• γ: 90°
• Cell volume: 1723.5 ± 0.6 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 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: 0.041
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for all reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections: 0.929
• Goodness-of-fit parameter for all reflections included in the refinement: 0.929
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No