Information card for entry 1552777

Structure parameters

• Formula: C28 H28 Cl2 N4 Pt
• Calculated formula: C28 H28 Cl2 N4 Pt
• SMILES: c1cccc2c3cccc[n]3[Pt]3([n]12)[NH2]CCC[NH]3Cc1c2ccccc2cc2ccccc12.[Cl-].[Cl-]
• Title of publication: Crystal Structure of [<i>N</i>-(9-Anthracenylmethyl)-1,3-propanediamine](2,2′-bipyridine)platinum(II) Chloride
• Authors of publication: KIWADA, Tatsuto; TAKAYAMA, Hiroshi; KATAKASU, Hiromu; ODANI, Akira
• Journal of publication: X-ray Structure Analysis Online
• Year of publication: 2019
• Journal volume: 35
• Journal issue: 0
• Pages of publication: 39
• a: 11.2466 ± 0.0007 Å
• b: 17.3553 ± 0.001 Å
• c: 13.7027 ± 0.0009 Å
• α: 90°
• β: 100.501 ± 0.002°
• γ: 90°
• Cell volume: 2629.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0328
• Residual factor for significantly intense reflections: 0.0271
• Weighted residual factors for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.0619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No