Information card for entry 7013106

Structure parameters

• Formula: C20 H30 Mn N O6 P Re S3
• Calculated formula: C20 H30 Mn N O6 P Re S3
• Title of publication: Building of dithiocarbamate and dithiocarbimate ligands within a heterobimetallic core
• Authors of publication: Jing Li; Daniel Miguel; Dolores Morales; Víctor Riera; Angel Aguirre-Pérez; Santiago García-Granda
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 16
• Pages of publication: 3264 - 3269
• a: 11.146 ± 0.004 Å
• b: 16.565 ± 0.005 Å
• c: 15.537 ± 0.005 Å
• α: 90°
• β: 103.363 ± 0.012°
• γ: 90°
• Cell volume: 2791 ± 1.6 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 8
• 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: 0.0287
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.0507
• Weighted residual factors for all reflections included in the refinement: 0.0525
• 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: No
• Has Fobs: No