Information card for entry 4314809

Structure parameters

• Formula: C43 H38 Cl2 N4 O3 Os P
• Calculated formula: C43 H36 Cl2 N4 O3 Os P
• SMILES: c12ccccc1C=[N]1CC[N]3=Cc4ccccc4O[Os]13(C#N)(C#N)O2.c1(ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl.O
• Title of publication: trans-[OsIII(salen)(CN)2]-: A New Paramagnetic Building Block for the Construction of Molecule-Based Magnetic Materials
• Authors of publication: Jun-Fang Guo; Wai-Fun Yeung; Pui-Ha Lau; Xiu-Teng Wang; Song Gao; Wing-Tak Wong; Stephen Sin-Yin Chui; Chi-Ming Che; Wai-Yeung Wong; Tai-Chu Lau
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 1607 - 1614
• a: 10.3519 ± 0.0006 Å
• b: 12.8204 ± 0.0008 Å
• c: 15.8082 ± 0.0009 Å
• α: 110.232 ± 0.001°
• β: 93.355 ± 0.001°
• γ: 95.207 ± 0.001°
• Cell volume: 1951.3 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0318
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0729
• Weighted residual factors for all reflections included in the refinement: 0.074
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No