Information card for entry 4084677

Structure parameters

• Formula: C16 H15 N3 O Pt
• Calculated formula: C16 H15 N3 O Pt
• SMILES: [Pt]1([n]2c(c3c1cccn3=O)cccc2)(C)[n]1ccccc1
• Title of publication: Carbon‒Hydrogen versus Nitrogen‒Oxygen Bond Activation in Reactions of N-Oxide Derivatives of 2,2′-Bipyridine and 1,10-Phenanthroline with a Dimethylplatinum(II) Complex
• Authors of publication: Moustafa, Mohamed E.; Boyle, Paul D.; Puddephatt, Richard J.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 19
• Pages of publication: 5402
• a: 9.676 ± 0.002 Å
• b: 15.112 ± 0.003 Å
• c: 10.0545 ± 0.0018 Å
• α: 90°
• β: 94.505 ± 0.01°
• γ: 90°
• Cell volume: 1465.7 ± 0.5 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 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: 0.0404
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0375
• Weighted residual factors for all reflections included in the refinement: 0.0399
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No