Information card for entry 4323821

Structure parameters

• Chemical name: tris(2-aminoethyl)amine-trichloro-ruthenium(III) hydrochloric acid 1/2hydrate
• Formula: C6 H20 Cl4 N4 O0.5 Ru
• Calculated formula: C6 H11.5 Cl4 N4 O0.5 Ru
• Title of publication: Syntheses and Crystal Structures of Ruthenium Complexes of 1,4,8,11-Tetraazacyclotetradecane, Tris(2-aminoethyl)amine (tren), and Bis(2-aminoethyl)(iminomethyl)amine. A Microporous Layered Structure Consisting of {[K(tren)]2[RuCl6]}nn- and {(H5O2)4[RuCl6]}nn+
• Authors of publication: Ken Sakai; Yasutaka Yamada; Taro Tsubomura
• Journal of publication: Inorganic Chemistry
• Year of publication: 1996
• Journal volume: 35
• Pages of publication: 3163 - 3172
• a: 13.731 ± 0.002 Å
• b: 14.319 ± 0.004 Å
• c: 13.949 ± 0.002 Å
• α: 90°
• β: 90.77 ± 0.01°
• γ: 90°
• Cell volume: 2742.3 ± 0.9 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.0387
• Goodness-of-fit parameter for significantly intense reflections: 2.07
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No