Information card for entry 7045224

Structure parameters

• Formula: C48 H44 F8 N2 P2 Pd
• Calculated formula: C48 H44 F8 N2 P2 Pd
• SMILES: [Pd]1([P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1c(F)c(F)c(N2CCCCC2)c(F)c1F)c1c(F)c(F)c(c(F)c1F)N1CCCCC1
• Title of publication: Synthesis and antiproliferative activity of a series of new platinum and palladium diphosphane complexes.
• Authors of publication: Cullinane, Carleen; Deacon, Glen B.; Drago, Penny R.; Erven, Anja P.; Junk, Peter C.; Luu, Jenny; Meyer, Gerd; Schmitz, Simon; Ott, Ingo; Schur, Julia; Webster, Lorraine K.; Klein, Axel
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 6
• Pages of publication: 1918 - 1932
• a: 10.073 ± 0.002 Å
• b: 16.346 ± 0.003 Å
• c: 25.938 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4270.8 ± 1.4 ų
• Cell temperature: 446 ± 2 K
• Ambient diffraction temperature: 446 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0274
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.067
• Weighted residual factors for all reflections included in the refinement: 0.0671
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No