Information card for entry 4341773

Structure parameters

• Formula: C26 H25 Cl2 N7 O12 Zn
• Calculated formula: C26 H25 Cl2 N7 O12 Zn
• Title of publication: Studies of the Pathways Open to Copper Water Oxidation Catalysts Containing Proximal Hydroxy Groups During Basic Electrocatalysis.
• Authors of publication: Gerlach, Deidra L.; Bhagan, Salome; Cruce, Alex A.; Burks, Dalton B.; Nieto, Ismael; Truong, Hai T.; Kelley, Steven P.; Herbst-Gervasoni, Corey J; Jernigan, Katherine L.; Bowman, Michael K.; Pan, Shanlin; Zeller, Matthias; Papish, Elizabeth T.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Pages of publication: 141203162841007
• a: 9.754 ± 0.003 Å
• b: 13.84 ± 0.004 Å
• c: 13.883 ± 0.004 Å
• α: 114.647 ± 0.004°
• β: 101.039 ± 0.004°
• γ: 103.183 ± 0.004°
• Cell volume: 1569.1 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0822
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.1059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No