Information card for entry 1518498

Structure parameters

• Formula: C68 H116 As10 Co4
• Calculated formula: C68 As10 Co4
• SMILES: [As]123[As]4[As]56[As]7([As]1[Co]189%10457[cH]4[c]1([cH]8[c]9([c]%104C(C)(C)C)C(C)(C)C)C(C)(C)C)[Co]14576([As]62[As]2[As]89[As]%10([As]6[Co]6%11%12%1328%10[cH]2[c]6([cH]%11[c]%12([c]%132C(C)(C)C)C(C)(C)C)C(C)(C)C)[Co]268%1039[cH]3[c]2([cH]6[c]8([c]%103C(C)(C)C)C(C)(C)C)C(C)(C)C)[cH]2[c]1([cH]4[c]5([c]72C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Synthesis of arsenic-rich Asnligand complexes from yellow arsenic
• Authors of publication: Graßl, C.; Bodensteiner, M.; Zabel, M.; Scheer, M.
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 2
• Pages of publication: 1379
• a: 10.3921 ± 0.0005 Å
• b: 14.3707 ± 0.0007 Å
• c: 14.8262 ± 0.0008 Å
• α: 62.53 ± 0.005°
• β: 76.535 ± 0.004°
• γ: 79.819 ± 0.004°
• Cell volume: 1904.35 ± 0.19 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0877
• Residual factor for significantly intense reflections: 0.0796
• Weighted residual factors for significantly intense reflections: 0.2268
• Weighted residual factors for all reflections included in the refinement: 0.2345
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No