Information card for entry 4108414

Structure parameters

• Formula: C16 H16 In N O8 S2
• Calculated formula: C16 H8 In N O8 S2
• Title of publication: Homochiral Crystallization of Microporous Framework Materials from Achiral Precursors by Chiral Catalysis
• Authors of publication: Jian Zhang; Shumei Chen; Tao Wu; Pingyun Feng; Xianhui Bu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 12882 - 12883
• a: 13.51 ± 0.0001 Å
• b: 13.51 ± 0.0001 Å
• c: 16.0684 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2932.81 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 91
• Hermann-Mauguin space group symbol: P 41 2 2
• Hall space group symbol: P 4w 2c
• Residual factor for all reflections: 0.062
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1788
• Weighted residual factors for all reflections included in the refinement: 0.1842
• Goodness-of-fit parameter for all reflections included in the refinement: 1.234
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No