Information card for entry 7008632

Structure parameters

• Formula: C38 H34 Cl N13 Ni3 O10
• Calculated formula: C38 H34 Cl N13 Ni3 O10
• Title of publication: A magnetostructural study of linear NiII MnIII NiII, NiII CrIII NiII and triangular Ni(II)3 species containing (pyridine-2-aldoximato)nickel(II) unit as a building block.
• Authors of publication: Weyhermüller, Thomas; Wagner, Rita; Khanra, Sumit; Chaudhuri, Phalguni
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 15
• Pages of publication: 2539 - 2546
• a: 11.1498 ± 0.0003 Å
• b: 15.8194 ± 0.0003 Å
• c: 23.9548 ± 0.0006 Å
• α: 90°
• β: 102.13 ± 0.01°
• γ: 90°
• Cell volume: 4130.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0461
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for all reflections: 0.0821
• Weighted residual factors for significantly intense reflections: 0.0726
• Goodness-of-fit parameter for all reflections: 1.052
• Goodness-of-fit parameter for significantly intense reflections: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No