Information card for entry 4303447

Structure parameters

• Formula: C16 H26 Cl2 Fe N6 O12
• Calculated formula: C16 H26 Cl2 Fe N6 O12
• Title of publication: One-Pot, Template Syntheses of a New Class of Metallomacrocycles with a Tetraoxime Cyclic Skeleton
• Authors of publication: Shohei Tashiro; Ai Minoda; Mihoko Yamada; Mitsuhiko Shionoya
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 10093 - 10101
• a: 15.1943 ± 0.0007 Å
• b: 9.6651 ± 0.0004 Å
• c: 17.3481 ± 0.0011 Å
• α: 90°
• β: 101.947 ± 0.0019°
• γ: 90°
• Cell volume: 2492.5 ± 0.2 ų
• Cell temperature: 93.1 K
• Number of distinct elements: 6
• 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: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.1208
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No