Information card for entry 7027149

Structure parameters

• Formula: C30 H41 Cl2 Fe N8 O11 S
• Calculated formula: C30 H41 Cl2 Fe N8 O11 S
• Title of publication: FeIIPbII and FeIII complexes of macrocyclic compartmental ligands: different cyclization in stepwise template synthesis using FeII/PbII or FeIII/PbII pairs
• Authors of publication: Furutachi, Hideki; Ishida, Akiko; Miyasaka, Hitoshi; Fukita, Nobuo; Ohba, Masaaki; Ōkawa, Hisashi; Koikawa, Masayuki
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 3
• Pages of publication: 367
• a: 9.892 ± 0.003 Å
• b: 24.786 ± 0.007 Å
• c: 15.5 ± 0.004 Å
• α: 90°
• β: 95.38 ± 0.02°
• γ: 90°
• Cell volume: 3783.6 ± 1.9 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.1043
• Goodness-of-fit parameter for significantly intense reflections: 1.95
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No