Information card for entry 7133014

Structure parameters

• Formula: C94 H150 Mg N4 Ni2 O8
• Calculated formula: C94 H150 Mg N4 Ni2 O8
• Title of publication: Appropriation of group II metals: synthesis and characterisation of the first alkaline earth metal supported transition metal carbonite complexes.
• Authors of publication: Wolff, Siad; Ponsonby, Annabelle; Dallmann, André; Herwig, Christian; Beckmann, Fabian; Cula, Beatrice; Limberg, Christian
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 45
• Pages of publication: 5816 - 5819
• a: 10.3314 ± 0.0013 Å
• b: 12.155 ± 0.0015 Å
• c: 20.115 ± 0.003 Å
• α: 85.509 ± 0.005°
• β: 76.039 ± 0.005°
• γ: 68.417 ± 0.005°
• Cell volume: 2279.4 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0582
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1447
• Weighted residual factors for all reflections included in the refinement: 0.1473
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No