Information card for entry 4067402

Structure parameters

• Formula: C36 H30 N2 P2
• Calculated formula: C36 H30 N2 P2
• SMILES: c1(ccccc1)P(c1ccccc1)N(c1ccccc1)N(c1ccccc1)P(c1ccccc1)c1ccccc1
• Title of publication: Synthesis, Coordination Chemistry, and Catalysis of the First 1,2-Bis(diphenylphosphino)-1,2-diphenylhydrazine, Ph2PN(Ph)N(Ph)PPh2†
• Authors of publication: Aluri, Bhaskar R.; Peulecke, Normen; Müller, Bernd H.; Peitz, Stephan; Spannenberg, Anke; Hapke, Marko; Rosenthal, Uwe
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 1
• Pages of publication: 226
• a: 12.5395 ± 0.0006 Å
• b: 12.1391 ± 0.0003 Å
• c: 19.5058 ± 0.0008 Å
• α: 90°
• β: 106.893 ± 0.003°
• γ: 90°
• Cell volume: 2841 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• 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: 0.0784
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0657
• Weighted residual factors for all reflections included in the refinement: 0.0719
• Goodness-of-fit parameter for all reflections included in the refinement: 0.827
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No