Information card for entry 7200966

Structure parameters

• Formula: C20 H30 Mn N16 O4 S2
• Calculated formula: C20 H30 Mn N16 O4 S2
• Title of publication: Solvent-controlled assembly of supramolecular isomers: 2D (4,4) network, 1D ribbons of ring, and both 2D (4,4) networks and 1D ribbons of rings polycatenated in a 3D array
• Authors of publication: Zhu, Xia; Liu, Xun-Gao; Li, Bao-Long; Zhang, Yong
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 6
• Pages of publication: 997
• a: 8.6873 ± 0.001 Å
• b: 8.9324 ± 0.0011 Å
• c: 10.5653 ± 0.0015 Å
• α: 82.685 ± 0.008°
• β: 84.302 ± 0.009°
• γ: 70.617 ± 0.006°
• Cell volume: 765.66 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0476
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0882
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No