Information card for entry 7046017

Structure parameters

• Common name: cmpd_1
• Formula: C15 H19 Cl Mn N2 O5
• Calculated formula: C15 H19 Cl Mn N2 O5
• Title of publication: Transition metal complexes of a versatile polyalkoxy oxazolidine-based ligand derived from in situ cyclization.
• Authors of publication: Saleem, Ayaan; Kobielska, Paulina A.; Harms, Klaus; Katsikogianni, Maria G.; Telford, Richard; Novitchi, Ghenadie; Nayak, Sanjit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 17
• Pages of publication: 6156 - 6165
• a: 13.1683 ± 0.0005 Å
• b: 8.5529 ± 0.0003 Å
• c: 14.3906 ± 0.0006 Å
• α: 90°
• β: 91.695 ± 0.002°
• γ: 90°
• Cell volume: 1620.06 ± 0.11 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: 0.0379
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.066
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No