Information card for entry 7041471

Structure parameters

• Formula: C73 H73 N11 O13 Zn2
• Calculated formula: C60 H46 N6 O10 Zn2
• Title of publication: {Fe3Nb25} cluster based on an Fe-centred Keggin unit.
• Authors of publication: Liang, Zhijie; Wang, Ke; Zhang, Dongdi; Ma, Pengtao; Niu, Jingyang; Wang, Jingping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 5
• Pages of publication: 1368 - 1371
• a: 17.525 ± 0.007 Å
• b: 17.373 ± 0.007 Å
• c: 23.693 ± 0.01 Å
• α: 90°
• β: 109.088 ± 0.004°
• γ: 90°
• Cell volume: 6817 ± 5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.136
• Residual factor for significantly intense reflections: 0.0905
• Weighted residual factors for significantly intense reflections: 0.2077
• Weighted residual factors for all reflections included in the refinement: 0.2328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No