Information card for entry 1512675

Structure parameters

• Chemical name: {(hapto^6^-p-Cymene)[N-(8-bromo-5,11-dihydroindolo[3,2-c]quinolin-6- ylidene)-kappaN'-(1-kappaN-pyridin-2-yl-ethylidene)]azine chloridoruthenium(II)}chloride monomethanol solvate
• Formula: C33 H34 Br Cl2 N5 O Ru
• Calculated formula: C33 H34 Br Cl2 N5 O Ru
• SMILES: [Ru]123456(Cl)([N](N=C7Nc8ccccc8c8[nH]c9c(c78)cc(Br)cc9)=C(C)c7[n]1cccc7)[c]1([cH]6[cH]5[c]4([cH]3[cH]21)C(C)C)C.[Cl-].OC
• Title of publication: Ruthenium- and Osmium-Arene Complexes of 8-Substituted Indolo[3,2-c]quinolines: Synthesis,X-ray Diffraction Structures, Spectroscopic Properties, and Antiproli- ferative Activity
• Authors of publication: Lukas K. Filak; Simone Goeschl; Stefanie Hackl; Michael A. Jakupec; Vladimir B. Arion
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 393
• Pages of publication: 252 - 260
• a: 9.3254 ± 0.0005 Å
• b: 13.5216 ± 0.0008 Å
• c: 13.5306 ± 0.0008 Å
• α: 67.646 ± 0.004°
• β: 89.989 ± 0.004°
• γ: 85.886 ± 0.003°
• Cell volume: 1573.17 ± 0.16 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: 0.0592
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No