Information card for entry 7220405

Structure parameters

• Common name: 4
• Formula: C36 H70 Cr2 N14 O17
• Calculated formula: C36 H70 Cr2 N14 O17
• Title of publication: Interplay of ligand chirality and metal configuration in mononuclear complexes and in a coordination polymer of Cr(iii)
• Authors of publication: Wang, Ai; Merkens, Carina; Englert, Ulli
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 23
• Pages of publication: 4293
• a: 7.1767 ± 0.0005 Å
• b: 12.5519 ± 0.0009 Å
• c: 14.7649 ± 0.001 Å
• α: 100.486 ± 0.0011°
• β: 93.4647 ± 0.0011°
• γ: 106.358 ± 0.0011°
• Cell volume: 1246.06 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0645
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1277
• Weighted residual factors for all reflections included in the refinement: 0.1367
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No