Information card for entry 7228792

Structure parameters

• Formula: C24 H22 Cl6 Cu2 N8 O2
• Calculated formula: C24 H22 Cl6 Cu2 N8 O2
• Title of publication: N9 substituent mediated structural tuning of copper‒purine complexes: chelate effect and thin film studies
• Authors of publication: Avasthi, Ilesha; Khanna, Shruti; Tripathi, Santosh K.; Verma, Sandeep
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 8.5142 ± 0.0015 Å
• b: 11.569 ± 0.002 Å
• c: 14.932 ± 0.003 Å
• α: 99.351 ± 0.001°
• β: 96.856 ± 0.002°
• γ: 90.793 ± 0.003°
• Cell volume: 1440.1 ± 0.5 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: 0.0553
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1344
• Weighted residual factors for all reflections included in the refinement: 0.1521
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No