Information card for entry 7712570

Structure parameters

• Formula: C14 H10 Br N2 O3 Re
• Calculated formula: C14 H10 Br N2 O3 Re
• Title of publication: Synthesis, characterization, and in vivo evaluation of the anticancer activity of a series of 5- and 6-(halomethyl)-2,2'-bipyridine rhenium tricarbonyl complexes.
• Authors of publication: Nasiri Sovari, Sara; Kolly, Isabelle; Schindler, Kevin; Djurić, Ana; Srdić-Rajić, Tatjana; Crochet, Aurelien; Pavic, Aleksandar; Zobi, Fabio
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 14.9333 ± 0.0005 Å
• b: 11.3306 ± 0.0002 Å
• c: 9.2074 ± 0.0003 Å
• α: 90°
• β: 106.894 ± 0.002°
• γ: 90°
• Cell volume: 1490.69 ± 0.08 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.042
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.1204
• Weighted residual factors for all reflections included in the refinement: 0.1207
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No