Information card for entry 1551612

Structure parameters

• Formula: C24 H36 N4 O2 Pt
• Calculated formula: C24 H36 N4 O2 Pt
• SMILES: [Pt]12(Nc3c(N1)ccc(c3)C(C)(C)C)Nc1c(N2)cc(cc1)C(C)(C)C.O1CCOCC1
• Title of publication: Crystal Structure of the <i>cis</i>-Bis(3-<i>tert</i>-butyl-<i>o</i>-diiminobenzosemiquinonato)platinum(II) Complex
• Authors of publication: MASUYA-SUZUKI, Atsuko; IKI, Nobuhiko
• Journal of publication: X-ray Structure Analysis Online
• Year of publication: 2016
• Journal volume: 32
• Journal issue: 0
• Pages of publication: 41
• a: 19.748 ± 0.002 Å
• b: 5.9608 ± 0.0007 Å
• c: 22.948 ± 0.003 Å
• α: 90°
• β: 113.455 ± 0.001°
• γ: 90°
• Cell volume: 2478.1 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0353
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0614
• Weighted residual factors for all reflections included in the refinement: 0.0651
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No