Information card for entry 4077643

Structure parameters

• Formula: C26 H22 Cr Mn N O8
• Calculated formula: C26 H22 Cr Mn N O8
• Title of publication: Organometallic Helices: The Mechanism of Formation of “Metallospiralenes”
• Authors of publication: Djukic, Jean-Pierre; Maisse-François, Aline; Pfeffer, Michel; Dötz, Karl Heinz; De Cian, André; Fischer, Jean
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 25
• Pages of publication: 5484
• a: 15.392 ± 0.0007 Å
• b: 10.891 ± 0.0005 Å
• c: 14.872 ± 0.0005 Å
• α: 90°
• β: 91.03 ± 0.002°
• γ: 90°
• Cell volume: 2492.65 ± 0.18 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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 all reflections: 0.063
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections: 1.604
• Goodness-of-fit parameter for all reflections included in the refinement: 1.509
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No