Information card for entry 4308655

Structure parameters

• Formula: C6 H15 Cu6 N S5
• Calculated formula: C6 H15 Cu6 N S5
• Title of publication: Transformation of Inorganic Sulfur into Organic Sulfur: A Novel Photoluminescent 3-D Polymeric Complex Involving Ligands in Situ Formation
• Authors of publication: Dan Li; Tao Wu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 1175 - 1177
• a: 8.5509 ± 0.0008 Å
• b: 9.1618 ± 0.0008 Å
• c: 11.8131 ± 0.0011 Å
• α: 74.262 ± 0.001°
• β: 87.636 ± 0.002°
• γ: 65.203 ± 0.001°
• Cell volume: 805.85 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.1129
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No