Information card for entry 4301905

Structure parameters

• Formula: C102 H126 Cu4 Mn5 N72 O54
• Calculated formula: C102 H78 Cu4 Mn5 N72 O54
• Title of publication: Magnetic [nxn] (n= 2-5) Grids by Directed Self-Assembly
• Authors of publication: Louise N. Dawe; Konstantin V. Shuvaev; Laurence K. Thompson
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 3323 - 3341
• a: 27.6101 ± 0.0016 Å
• b: 27.6101 ± 0.0016 Å
• c: 40.319 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 30736 ± 3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d :2
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.1128
• Residual factor for significantly intense reflections: 0.1009
• Weighted residual factors for significantly intense reflections: 0.2737
• Weighted residual factors for all reflections included in the refinement: 0.2837
• Goodness-of-fit parameter for all reflections included in the refinement: 1.219
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No