Information card for entry 4345520

Structure parameters

• Formula: C29 H21 Cl4 N3 Pt
• Calculated formula: C29 H21 Cl4 N3 Pt
• SMILES: [Pt]12(N(c3c4[n]2cc2c(c4cc(c3)C)cccc2)c2c3[n]1cc1c(c3cc(c2)C)cccc1)Cl.ClC(Cl)Cl
• Title of publication: Phenanthridine-Containing Pincer-like Amido Complexes of Nickel, Palladium, and Platinum.
• Authors of publication: Mandapati, Pavan; Giesbrecht, Patrick K.; Davis, Rebecca L.; Herbert, David E.
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 6
• Pages of publication: 3674 - 3685
• a: 7.106 ± 0.0003 Å
• b: 13.4541 ± 0.0005 Å
• c: 14.0548 ± 0.0005 Å
• α: 101.356 ± 0.0016°
• β: 100.544 ± 0.0016°
• γ: 98.51 ± 0.0016°
• Cell volume: 1271.34 ± 0.09 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.027
• Residual factor for significantly intense reflections: 0.0209
• Weighted residual factors for significantly intense reflections: 0.0419
• Weighted residual factors for all reflections included in the refinement: 0.0445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.137
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No