Information card for entry 7125186

Structure parameters

• Formula: C125 H187 Fe N8 O2 P5 Sm2
• Calculated formula: C125 H187 Fe N8 O2 P5 Sm2
• Title of publication: Sterically induced reductive linkage of iron polypnictides with bulky lanthanide complexes by ring-opening of THF.
• Authors of publication: Schoo, Christoph; Bestgen, Sebastian; Schmidt, Monika; Konchenko, Sergey N.; Scheer, Manfred; Roesky, Peter W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 90
• Pages of publication: 13217 - 13220
• a: 13.12 ± 0.003 Å
• b: 20.386 ± 0.004 Å
• c: 24.637 ± 0.005 Å
• α: 109.26 ± 0.03°
• β: 93.54 ± 0.03°
• γ: 93.97 ± 0.03°
• Cell volume: 6181 ± 3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 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: 0.0555
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0662
• Weighted residual factors for all reflections included in the refinement: 0.0702
• Goodness-of-fit parameter for all reflections included in the refinement: 0.85
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No