Information card for entry 7716746

Structure parameters

• Chemical name: PB-138
• Formula: C10 H5 Fe O6 P
• Calculated formula: C10 H5 Fe O6 P
• Title of publication: Facile synthesis of five-membered cyclic RE₂P-H iron(0) complexes.
• Authors of publication: Brehm, Philipp C.; Schnakenburg, Gregor; Streubel, Rainer
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 31
• Pages of publication: 13201 - 13206
• a: 16.151 ± 0.002 Å
• b: 10.43 ± 0.0012 Å
• c: 6.819 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1148.7 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.04
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0702
• Weighted residual factors for all reflections included in the refinement: 0.0725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No