Information card for entry 4317471

Structure parameters

• Chemical name: tetraphenylphosphoniumtetraethylammonium cis-Irontetracyanidedicarbonyl
• Formula: C38 H40 Fe N5 O2 P
• Calculated formula: C38 H20 Fe N5 O2 P
• Title of publication: fac-[FeII(CN)3(CO)3]- and cis-[FeII(CN)4(CO)2]2-: New Members of the Class of [FeII(CN)x(CO)y] Compounds
• Authors of publication: Jianfeng Jiang; Stephen A. Koch
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 158 - 160
• a: 11.476 ± 0.002 Å
• b: 29.561 ± 0.006 Å
• c: 11.246 ± 0.002 Å
• α: 90°
• β: 109.23 ± 0.03°
• γ: 90°
• Cell volume: 3602.2 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0971
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1605
• Weighted residual factors for all reflections included in the refinement: 0.1906
• Goodness-of-fit parameter for all reflections included in the refinement: 0.948
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No