Information card for entry 7035307

Structure parameters

• Formula: C130.6 H98.4 Mo4 N48 Ni8 O14.6
• Calculated formula: C130.6 H71.8 Mo4 N48 Ni8 O14.6
• Title of publication: New topology of CN-bridged clusters: dodecanuclear face-sharing defective cubes based on octacyanometallates(iv) and nickel(ii) with diimine ligands.
• Authors of publication: Nowicka, Beata; Näther, Christian; Halemba, Alexandra; Reczyński, Mateusz; Sieklucka, Barbara
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 28
• Pages of publication: 12780 - 12787
• a: 14.1796 ± 0.0005 Å
• b: 15.6667 ± 0.0007 Å
• c: 21.9922 ± 0.0009 Å
• α: 95.044 ± 0.003°
• β: 107.31 ± 0.003°
• γ: 109.261 ± 0.003°
• Cell volume: 4308.3 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0767
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1542
• Weighted residual factors for all reflections included in the refinement: 0.163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No