Information card for entry 7112671

Structure parameters

• Common name: Tetraethylammonium (bis((N,N'-Bis(5- bromosalicylidene)ethylenediamine)(methanol)manganese(iii)) mu- (hexacyanidoruthenate(iii)))
• Chemical name: Tetraethylammonium {bis[(N,N'-Bis(5-bromosalicylidene)ethylenediamine)(methanol)manganese(iii)] μ-[hexacyanidoruthenate(iii)]}
• Formula: C48 H52 Br4 Mn2 N11 O6 Ru
• Calculated formula: C48 H52 Br4 Mn2 N11 O6 Ru
• Title of publication: A linear single-molecule magnet based on [Ru(III)(CN)6]3-.
• Authors of publication: Pedersen, Kasper S.; Dreiser, Jan; Nehrkorn, Joscha; Gysler, Maren; Schau-Magnussen, Magnus; Schnegg, Alexander; Holldack, Karsten; Bittl, Robert; Piligkos, Stergios; Weihe, Høgni; Tregenna-Piggott, Philip; Waldmann, Oliver; Bendix, Jesper
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2011
• Journal volume: 47
• Journal issue: 24
• Pages of publication: 6918 - 6920
• a: 12.3004 ± 0.0016 Å
• b: 15.5434 ± 0.0018 Å
• c: 15.689 ± 0.003 Å
• α: 90°
• β: 115.318 ± 0.01°
• γ: 90°
• Cell volume: 2711.5 ± 0.7 ų
• Cell temperature: 122 ± 1 K
• Ambient diffraction temperature: 122 ± 1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.0594
• Weighted residual factors for all reflections included in the refinement: 0.0662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No