Information card for entry 7015219

Structure parameters

• Formula: C98 H108 Cl4 F12 N8 O12 Rh4 S4
• Calculated formula: C98 H108 Cl4 F12 N8 O12 Rh4 S4
• Title of publication: Bis-imine-cyclometalated macrocycles: synthesis, characterization and observation of solution behaviour.
• Authors of publication: Li, Hao; Han, Ying-Feng; Jin, Guo-Xin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 18
• Pages of publication: 4982 - 4993
• a: 11.693 ± 0.01 Å
• b: 33.35 ± 0.03 Å
• c: 15.824 ± 0.014 Å
• α: 90°
• β: 109.94 ± 0.012°
• γ: 90°
• Cell volume: 5801 ± 9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• 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: 0.1199
• Residual factor for significantly intense reflections: 0.0645
• Weighted residual factors for significantly intense reflections: 0.154
• Weighted residual factors for all reflections included in the refinement: 0.1693
• Goodness-of-fit parameter for all reflections included in the refinement: 0.866
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No