Information card for entry 4504027

Structure parameters

• Formula: C34 H32 Co N6 O9 S2
• Calculated formula: C34 H32 Co N6 O9 S2
• Title of publication: Guest-Induced Helical Metallacyclic Chains in a Porous Coordination Solid Constructed from a Flexible Ester-Containing Ligand
• Authors of publication: Huang, Kexuan; Xu, Zhengjiang; Li, Yizhi; Zheng, Hegen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 2
• Pages of publication: 202
• a: 13.267 ± 0.002 Å
• b: 19.111 ± 0.004 Å
• c: 14.501 ± 0.003 Å
• α: 90°
• β: 91.1 ± 0.004°
• γ: 90°
• Cell volume: 3676 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1444
• Residual factor for significantly intense reflections: 0.0735
• Weighted residual factors for significantly intense reflections: 0.1594
• Weighted residual factors for all reflections included in the refinement: 0.1706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.183
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No