Information card for entry 7036766

Structure parameters

• Formula: C36 H36 O27 Zn5
• Calculated formula: C36 H36 O27 Zn5
• Title of publication: Coordination polymers of Zn(II) and 5-methoxy isophthalate.
• Authors of publication: McCormick, Laura J.; Morris, Samuel A.; Teat, Simon J.; McPherson, Matthew J.; Slawin, Alexandra M. Z.; Morris, Russell E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 40
• Pages of publication: 17686 - 17695
• a: 10.4446 ± 0.0018 Å
• b: 27.372 ± 0.004 Å
• c: 14.877 ± 0.002 Å
• α: 90°
• β: 106.291 ± 0.007°
• γ: 90°
• Cell volume: 4082.4 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.098
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1082
• Weighted residual factors for all reflections included in the refinement: 0.1284
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No