Information card for entry 7013110

Structure parameters

• Formula: C16 H28 N2 O4 Pt
• Calculated formula: C16 H28 N2 O4 Pt
• SMILES: [Pt]1(O)(O)([n]2c(cc(cc2)C)c2[n]1ccc(c2)C)(C)C.OC.OC
• Title of publication: Synthesis, characterization, and acid‒base properties of (N‒N)PtIV(CH3)2(OH)2 − x(OCH3)x(x= 0, 1) complexes
• Authors of publication: Knut Thorshaug; Irene Fjeldahl; Christian Rømming; Mats Tilset
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 21
• Pages of publication: 4051 - 4056
• a: 7.2537 ± 0.0005 Å
• b: 10.987 ± 0.0009 Å
• c: 12.0195 ± 0.0009 Å
• α: 81.881 ± 0.003°
• β: 87.298 ± 0.003°
• γ: 74.897 ± 0.004°
• Cell volume: 915.5 ± 0.12 ų
• Cell temperature: 105 ± 2 K
• Ambient diffraction temperature: 105 ± 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: 0.0339
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0648
• Weighted residual factors for all reflections included in the refinement: 0.0669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No