Information card for entry 7020349

Structure parameters

• Common name: N,:'-(butane-1,4-diyl)bis(2-methylisonicotinamide)
• Chemical name: N,:'-(butane-1,4-diyl)bis(2-methylisonicotinamide)
• Formula: C36 H52 N8 O8
• Calculated formula: C36 H52 N8 O8
• Title of publication: Combining aspects of the platinum anticancer drugs picoplatin and BBR3464 to synthesize a new family of sterically hindered dinuclear complexes; their synthesis, binding kinetics and cytotoxicity.
• Authors of publication: Brown, Sarah D.; Trotter, Katherine D.; Sutcliffe, Oliver B.; Plumb, Jane A.; Waddell, Bruce; Briggs, Naomi E. B.; Wheate, Nial J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 37
• Pages of publication: 11330 - 11339
• a: 7.3486 ± 0.0003 Å
• b: 12.1524 ± 0.0007 Å
• c: 12.353 ± 0.0006 Å
• α: 66.27 ± 0.005°
• β: 77.808 ± 0.004°
• γ: 72.732 ± 0.004°
• Cell volume: 959.05 ± 0.09 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No