Information card for entry 7036767

Structure parameters

• Formula: C9 H12 O8 Zn
• Calculated formula: C9 H12 O8 Zn
• 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: 7.708 ± 0.003 Å
• b: 8.505 ± 0.004 Å
• c: 9.689 ± 0.004 Å
• α: 112.204 ± 0.016°
• β: 90.766 ± 0.011°
• γ: 102.26 ± 0.011°
• Cell volume: 571.6 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No