Information card for entry 7226575

Structure parameters

• Formula: C34 H35 Cl N2 O2 Ru
• Calculated formula: C34 H35 Cl N2 O2 Ru
• SMILES: [Ru]123456(Oc7ccccc7C=[N]1c1ccc(cc1)C(=O)/C=C/c1ccc(N(C)C)cc1)(Cl)[c]1([cH]2[cH]3[c]4([cH]5[cH]61)C(C)C)C
• Title of publication: Arene Ruthenium (II) Complexes with Chalcone, Aminoantipyrine and Aminopyrimidine Based Ligands: Synthesis, Structure and Preliminary Evaluation of Anti-leukemia Activity
• Authors of publication: Pitchaimani, J.; Raja, MR Charan; Srinivasan, Sujatha; Kar Mahapatra, Santanu; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 9.096 ± 0.0018 Å
• b: 11.993 ± 0.002 Å
• c: 14.283 ± 0.003 Å
• α: 74.2 ± 0.03°
• β: 75.55 ± 0.03°
• γ: 89.72 ± 0.03°
• Cell volume: 1448.5 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.0762
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.61 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No