Information card for entry 4074012

Structure parameters

• Chemical name: (hapto^6^-p-Cymene)[N-(9-bromo-7,12-dihydroindolo[3,2-d][1]benzazepin- kappaN-6-yl)-N'-kappaN-(3-hydroxy-5-(hydroxymethyl)-2-methyl-pyridin- 4-yl-methylene)azine]chloroosmium(II) acetone water solvate
• Formula: C77 H88.2 Br2 Cl4 N10 O8.1 Os2
• Calculated formula: C77 H86 Br2 Cl4 N10 O8.1 Os2
• Title of publication: Highly Antiproliferative Ruthenium(II) and Osmium(II) Arene Complexes with Paullone-Derived Ligands
• Authors of publication: Schmid, Wolfgang F.; John, Roland O.; Arion, Vladimir B.; Jakupec, Michael A.; Keppler, Bernhard K.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 26
• Pages of publication: 6643
• a: 13.1551 ± 0.0007 Å
• b: 16.7459 ± 0.0009 Å
• c: 19.1476 ± 0.0009 Å
• α: 81.092 ± 0.003°
• β: 83.527 ± 0.003°
• γ: 72.158 ± 0.004°
• Cell volume: 3957.2 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0584
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0872
• Weighted residual factors for all reflections included in the refinement: 0.0928
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No