Information card for entry 7023628

Structure parameters

• Formula: C6 H18 Ni3 O18
• Calculated formula: C6 H18 Ni3 O18
• Title of publication: Layered transition metal carboxylates: synthesis, structural aspects and observation of multi-step magnetic transition through phase diagram.
• Authors of publication: Sen, Rupam; Mal, Dasarath; Lopes, Armandina M. L.; Brandão, Paula; Araújo, João P; Lin, Zhi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 41
• Pages of publication: 14836 - 14843
• a: 9.914 ± 0.007 Å
• b: 5.449 ± 0.004 Å
• c: 15.142 ± 0.011 Å
• α: 90°
• β: 105.99 ± 0.03°
• γ: 90°
• Cell volume: 786.3 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0991
• Weighted residual factors for all reflections included in the refinement: 0.1076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No