Information card for entry 4000127

Structure parameters

• Formula: C14 H12 Cl4 Co0.4 Fe0.6 S12
• Calculated formula: C14 H12 Cl4 Co0.44 S12
• SMILES: Cl[Co](Cl)([Cl-])[Cl-].CSC1=C(SC)SC(=C2SC3=C(S2)SC(=C2SC(=C(S2)SC)SC)S3)S1
• Journal of publication: Chemistry of Materials
• Year of publication: 2002
• a: 24.073 ± 0.006 Å
• b: 5.847 ± 0.007 Å
• c: 22.45 ± 0.01 Å
• α: 90°
• β: 118.93 ± 0.03°
• γ: 90°
• Cell volume: 2765 ± 3 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No