Information card for entry 7056301

Structure parameters

• Formula: C61 H36 Cl6 Cr2 N10 O14
• Calculated formula: C61 H36 Cl6 Cr2 N10 O14
• Title of publication: Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers
• Authors of publication: Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 14
• Pages of publication: 6785 - 6794
• a: 11.2439 ± 0.0005 Å
• b: 11.9828 ± 0.0004 Å
• c: 12.2375 ± 0.0005 Å
• α: 67.691 ± 0.004°
• β: 71.274 ± 0.004°
• γ: 82.655 ± 0.003°
• Cell volume: 1444.61 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for all reflections included in the refinement: 0.1473
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 1.54179 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No