Information card for entry 7110378

Structure parameters

• Formula: C4 H20 Cu Mo2.5 N4 O13 P
• Calculated formula: C4 H20 Cu Mo2.5 N4 O13 P
• Title of publication: Hydrothermal assembly and structural characterisation of one- and two-dimensional organic/inorganic hybrid materials constructed from diphosphopentamolybdate(VI) clusters and {Cu(en)}2+ complex groups
• Authors of publication: Lu, Jianjiang; Xu, Yan; Goh, Ngoh K.; Chia, Lian S.
• Journal of publication: Chemical Communications
• Year of publication: 1998
• Journal issue: 24
• Pages of publication: 2733
• a: 11.478 ± 0.004 Å
• b: 39.171 ± 0.008 Å
• c: 15.226 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6846 ± 4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 73
• Hermann-Mauguin space group symbol: I b c a
• Hall space group symbol: -I 2b 2c
• Residual factor for all reflections: 0.0288
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for all reflections: 0.0694
• Weighted residual factors for significantly intense reflections: 0.0603
• Goodness-of-fit parameter for all reflections: 1.109
• Goodness-of-fit parameter for significantly intense reflections: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No