Information card for entry 4329766

Structure parameters

• Formula: C8 H53 Mo6 N5.25 O39 P4 Rb0.75 S2
• Calculated formula: C8 H16 Mo6 O40 P4 Rb0.75 S2
• Title of publication: Polyoxometalates Functionalized by Bisphosphonate Ligands: Synthesis, Structural, Magnetic, and Spectroscopic Characterizations and Activity on Tumor Cell Lines
• Authors of publication: Hani El Moll; Wei Zhu; Eric Oldfield; L. Marleny Rodriguez-Albelo; Pierre Mialane; Jérôme Marrot; Neus Vila; Israel Martyr Mbomekallé; Eric Rivière; Carole Duboc; Anne Dolbecq
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 7921 - 7931
• a: 9.3739 ± 0.0008 Å
• b: 15.2154 ± 0.0013 Å
• c: 17.8484 ± 0.0015 Å
• α: 104.176 ± 0.002°
• β: 94.472 ± 0.002°
• γ: 96.615 ± 0.002°
• Cell volume: 2436.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0832
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1481
• Weighted residual factors for all reflections included in the refinement: 0.1619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No