Information card for entry 7717638

Structure parameters

• Formula: C30 H24 Cl2 Cu N6 O9
• Calculated formula: C30 H24 Cl2 Cu N6 O9
• Title of publication: A Terpyridine based Copper Complex for Electrochemical Reduction of Nitrite to Nitric Oxide
• Authors of publication: Biswas, Jyotiprokash; Sanden, Sebastian; Bhardwaj, Prabhakar; Siegmund, Daniel; Kumar, Pankaj; Apfel, Ulf-Peter
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 8.7098 ± 0.0002 Å
• b: 8.8878 ± 0.0002 Å
• c: 19.9949 ± 0.0005 Å
• α: 90°
• β: 98.082 ± 0.002°
• γ: 90°
• Cell volume: 1532.45 ± 0.06 ų
• Cell temperature: 104.1 ± 0.5 K
• Ambient diffraction temperature: 104.1 ± 0.5 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.047
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1023
• Weighted residual factors for all reflections included in the refinement: 0.105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No