Information card for entry 4322113

Structure parameters

• Chemical name: bis(histamine)copper(II) thiocyanate
• Formula: C12 H18 Cu N8 S2
• Calculated formula: C12 H18 Cu N8 S2
• Title of publication: Copper(II) Complexes of Histamine and Cysteine Produced by Thiosulfate-Assisted Synthesis Using Copper(I) Cyanide. The in Situ Formation of the Thiocyanate Anion and the 2-Amino-2-thiazoline-4-carboxylic Acid Ligand
• Authors of publication: Fred B. Stocker; Paul Fadden; Spencer Dreher; Doyle Britton
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 3251 - 3253
• a: 8.552 ± 0.002 Å
• b: 9.254 ± 0.002 Å
• c: 11.625 ± 0.002 Å
• α: 87.81 ± 0.02°
• β: 85.74 ± 0.02°
• γ: 66.93 ± 0.02°
• Cell volume: 844 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 297 ± 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: 0.064
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for all reflections: 0.1112
• Weighted residual factors for significantly intense reflections: 0.1006
• Goodness-of-fit parameter for all reflections: 1.033
• Goodness-of-fit parameter for significantly intense reflections: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No