Information card for entry 2205987

Structure parameters

• Chemical name: Carbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)(triphenylphosphine)iron(II) trifluoromethanesulfonate dichloromethane hemisolvate
• Formula: C29.5 H30 Cl F3 Fe N O4 P S Si
• Calculated formula: C29.5 H30 Cl F3 Fe N O4 P S Si
• Title of publication: Carbonyl(η^5^-cyclopentadienyl)(trimethylsilyl isocyanide)(triphenylphosphine)iron(II) trifluoromethanesulfonate dichloromethane hemisolvate
• Authors of publication: Hiroshi Nakazawa; Masumi Itazaki; Mari Owaribe
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 6
• Pages of publication: m1172 - m1173
• a: 9.429 ± 0.002 Å
• b: 13.055 ± 0.003 Å
• c: 13.51 ± 0.003 Å
• α: 95.995 ± 0.004°
• β: 100.673 ± 0.004°
• γ: 96.272 ± 0.004°
• Cell volume: 1611.2 ± 0.6 ų
• Cell temperature: 203.2 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for all reflections included in the refinement: 0.154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes