Information card for entry 7219085

Structure parameters

• Formula: C23 H34 Mg2 N3 O14 S2
• Calculated formula: C23 H34 Mg2 N3 O14 S2
• Title of publication: Solvent-assisted construction of diverse Mg-TDC coordination polymers
• Authors of publication: Song, Ying; Feng, Mei-Ling; Wu, Zhao-Feng; Huang, Xiao-Ying
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 6
• Pages of publication: 1348
• a: 12.9363 ± 0.0006 Å
• b: 15.858 ± 0.0008 Å
• c: 9.0474 ± 0.0007 Å
• α: 90°
• β: 120.978 ± 0.01°
• γ: 90°
• Cell volume: 1591.3 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 8
• Hermann-Mauguin space group symbol: C 1 m 1
• Hall space group symbol: C -2y
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1087
• Weighted residual factors for all reflections included in the refinement: 0.1158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No