Information card for entry 4114137

Structure parameters

• Formula: C12.33 H8.67 Cl0.67 Cr0.33 Mn0.33 O4 S4 Se4
• Calculated formula: C10 H8 S4 Se4
• Title of publication: A Molecular Metal Ferromagnet from the Organic Donor Bis(ethylenedithio)tetraselenafulvalene and Bimetallic Oxalate Complexes
• Authors of publication: Antonio Alberola; Eugenio Coronado; José R. Galán-Mascarós; Carlos Giménez-Saiz; Carlos J. Gómez-García
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 10774 - 10775
• a: 4.356 ± 0.002 Å
• b: 11.575 ± 0.003 Å
• c: 20.09 ± 0.004 Å
• α: 91.71 ± 0.03°
• β: 92.9 ± 0.03°
• γ: 90.04 ± 0.03°
• Cell volume: 1011.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1787
• Residual factor for significantly intense reflections: 0.106
• Weighted residual factors for significantly intense reflections: 0.2533
• Weighted residual factors for all reflections included in the refinement: 0.3193
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No