Information card for entry 7009702

Structure parameters

• Formula: C42 H38 Cl N2 O5 P2 Re
• Calculated formula: C42 H38 Cl N2 O5.5 P2 Re
• Title of publication: Novel six-co-ordinate oxorhenium complexes with ligands containing PN2 and PNO donor atom sets: syntheses and structural characterization
• Authors of publication: Correia, João D. G.; Domingos, Ângela; Paulo, António; Santos, Isabel
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 14
• Pages of publication: 2477
• a: 14.3 ± 0.003 Å
• b: 16.977 ± 0.002 Å
• c: 18.752 ± 0.004 Å
• α: 92.57 ± 0.014°
• β: 109.78 ± 0.02°
• γ: 96.122 ± 0.013°
• Cell volume: 4243.5 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1375
• Residual factor for significantly intense reflections: 0.075
• Weighted residual factors for all reflections: 0.2657
• Weighted residual factors for significantly intense reflections: 0.1853
• Goodness-of-fit parameter for all reflections: 1.063
• Goodness-of-fit parameter for significantly intense reflections: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No