Information card for entry 7106413

Structure parameters

• Formula: C27 H35 Cl2 N9 O10 Zn
• Calculated formula: C27 H35 Cl2 N9 O10 Zn
• Title of publication: Modular 'click' sensors for zinc and their application in vivo
• Authors of publication: Jobe, Kajally; Brennan, Caroline H.; Motevalli, Majid; Goldup, Stephen M.; Watkinson, Michael
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2011
• Journal volume: 47
• Journal issue: 21
• Pages of publication: 6036 - 6038
• a: 12.2193 ± 0.0002 Å
• b: 12.3857 ± 0.0002 Å
• c: 42.4545 ± 0.0008 Å
• α: 90°
• β: 90.692 ± 0.001°
• γ: 90°
• Cell volume: 6424.79 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0643
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.142
• Weighted residual factors for all reflections included in the refinement: 0.1422
• Goodness-of-fit parameter for all reflections included in the refinement: 1.322
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No