Information card for entry 4329159

Structure parameters

• Formula: C34 H39 Cl2 Cu N7 O10
• Calculated formula: C34 H39 Cl2 Cu N7 O10
• SMILES: [Cu]123([n]4c5ccccc5[nH]c4C[NH]1Cc1[n]2c2c([nH]1)cccc2)[n]1c2c4[n]3cccc4c(c(c2ccc1)C)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O(CC)CC.O
• Title of publication: Mixed Ligand Copper(II) Complexes of N,N-Bis(benzimidazol-2-ylmethyl)amine (BBA) with Diimine Co-Ligands: Efficient Chemical Nuclease and Protease Activities and Cytotoxicity
• Authors of publication: Rangasamy Loganathan; Sethu Ramakrishnan; Eringathodi Suresh; Anvarbatcha Riyasdeen; Mohamad Abdulkadhar Akbarsha; Mallayan Palaniandavar
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 5512 - 5532
• a: 13.3357 ± 0.0004 Å
• b: 17.1139 ± 0.0005 Å
• c: 17.4396 ± 0.0005 Å
• α: 90°
• β: 107.518 ± 0.001°
• γ: 90°
• Cell volume: 3795.58 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0863
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1499
• Weighted residual factors for all reflections included in the refinement: 0.1723
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No