Information card for entry 7011409

Structure parameters

• Common name: CuP2Mo5O23(H2O)2(Hcyt)4
• Formula: C8 H14 Cu0.5 Mo2.5 N6 O14.5 P
• Calculated formula: C16 H24 Cu Mo5 N12 O29 P2
• Title of publication: A nucleobase‒inorganic hybrid polymer consisting of copper bis(phosphopentamolybdate) and cytosine
• Authors of publication: Jiabao Weng; Maochun Hong; Yucang Liang; Qian Shi; Rong Cao
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 3
• Pages of publication: 289 - 290
• a: 19.3411 ± 0.0004 Å
• b: 11.4945 ± 0.0002 Å
• c: 19.4712 ± 0.0001 Å
• α: 90°
• β: 117.617 ± 0.001°
• γ: 90°
• Cell volume: 3835.57 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0825
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1653
• Weighted residual factors for all reflections included in the refinement: 0.1802
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No