Information card for entry 7063342

Structure parameters

• Formula: C8 H6 N8 O2 Rb2 W
• Calculated formula: C8 H6 N8 O2 Rb2 W
• Title of publication: Synthesis of diaminoacetylene from cyanido ligands of the octacyanidotungstate complex
• Authors of publication: Szklarzewicz, Janusz; Hodorowicz, Maciej; Jurowska, Anna
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• Journal volume: 48
• Journal issue: 29
• Pages of publication: 13196 - 13205
• a: 8.5484 ± 0.0002 Å
• b: 14.3462 ± 0.0003 Å
• c: 12.877 ± 0.0002 Å
• α: 90°
• β: 90.846 ± 0.002°
• γ: 90°
• Cell volume: 1579.03 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293.49 ± 0.13 K
• Number of distinct elements: 6
• 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: 0.0304
• Residual factor for significantly intense reflections: 0.0233
• Weighted residual factors for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No