Information card for entry 7028362

Structure parameters

• Common name: 9-allylguanine+CuCl2
• Formula: C52 H70 Cl6 Cu3 N30 O10
• Calculated formula: C52 H70 Cl6 Cu3 N30 O10
• Title of publication: Guanine-copper coordination polymers: crystal analysis and application as thin film precursors.
• Authors of publication: Nagapradeep, N.; Venkatesh, V.; Tripathi, S. K.; Verma, Sandeep
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 4
• Pages of publication: 1744 - 1752
• a: 10.0805 ± 0.0012 Å
• b: 10.2327 ± 0.0012 Å
• c: 17.619 ± 0.002 Å
• α: 74.604 ± 0.003°
• β: 78.168 ± 0.002°
• γ: 87.898 ± 0.002°
• Cell volume: 1714.7 ± 0.3 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: 0.0593
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1418
• Weighted residual factors for all reflections included in the refinement: 0.1594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No