Information card for entry 4512527

Structure parameters

• Formula: C15 H19 Cu N7 O6
• Calculated formula: C15 H19 Cu N7 O6
• Title of publication: Imine Component Based Modified Adenine Nucleobase‒Metal Frameworks
• Authors of publication: Pratibha,; Verma, Sandeep
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 1
• Pages of publication: 510
• a: 13.0605 ± 0.0009 Å
• b: 16.4911 ± 0.0012 Å
• c: 16.6975 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3596.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0867
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1284
• Weighted residual factors for all reflections included in the refinement: 0.1583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No