Information card for entry 7013843

Structure parameters

• Formula: C115 H125 F30 N30 O19 P5 Zn4
• Calculated formula: C59.8333 H40 F17.2 N13 O9.33333 P3.00667 Zn2
• Title of publication: Self-assembly of molecular squares based on easy-to-prepare multidentate Schiff base ligands.
• Authors of publication: He, Zheng; He, Cheng; Wang, Zhe-Ming; Gao, En-Qing; Liu, Yuan; Yan, Chun-Hua
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 4
• Pages of publication: 502 - 504
• a: 39.488 ± 0.006 Å
• b: 39.488 ± 0.006 Å
• c: 25.498 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 34432 ± 10 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 194
• Hermann-Mauguin space group symbol: P 63/m m c
• Hall space group symbol: -P 6c 2c
• Residual factor for all reflections: 0.145
• Residual factor for significantly intense reflections: 0.0852
• Weighted residual factors for significantly intense reflections: 0.2267
• Weighted residual factors for all reflections included in the refinement: 0.2542
• Goodness-of-fit parameter for all reflections included in the refinement: 0.916
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No