Information card for entry 4070205

Structure parameters

• Formula: C48.45 H85.9 Cl1.9 F6 N5 O2 Os P3
• Calculated formula: C48.45 H75.5 Cl1.9 F6 N5 O2 Os P3
• Title of publication: Osmium−Alkenylcarbyne and −Alkenylcarbene Complexes with an Steroid Skeleton: Formation of a Testosterone Organometallic Derivative Containing the 7H-Amino Adenine Tautomer
• Authors of publication: Buil, María L.; Esteruelas, Miguel A.; Garcés, Karin; Oñate, Enrique
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 19
• Pages of publication: 5691
• a: 11.317 ± 0.0016 Å
• b: 16.066 ± 0.002 Å
• c: 18.498 ± 0.003 Å
• α: 109.375 ± 0.003°
• β: 93.131 ± 0.003°
• γ: 97.394 ± 0.003°
• Cell volume: 3129.4 ± 0.8 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 8
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.1348
• Residual factor for significantly intense reflections: 0.0879
• Weighted residual factors for significantly intense reflections: 0.2103
• Weighted residual factors for all reflections included in the refinement: 0.2313
• Goodness-of-fit parameter for all reflections included in the refinement: 1.207
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No