Information card for entry 7003040

Structure parameters

• Common name: (N,N'-ethylenediaminediacetato)(1,10- phenanthroline)copper(ii) pentahydrate
• Chemical name: (N,N'-ethylenediaminediacetato)(1,10-phenanthroline)copper(II) pentahydrate
• Formula: C18 H28 Cu N4 O9
• Calculated formula: C18 H28 Cu N4 O9
• SMILES: [Cu]1234(OC(=O)C[NH]3CC[NH]4CC(=O)O1)[n]1c3c(ccc1)ccc1ccc[n]2c31.O.O.O.O.O
• Title of publication: Synthesis, characterization, DNA-binding study and anticancer properties of ternary metal(ii) complexes of edda and an intercalating ligand
• Authors of publication: Ng, Chew Hee; Kong, King Chow; Von, Sze Tin; Balraj, Pauline; Jensen, Paul; Thirthagiri, Eswary; Hamada, Hirokazu; Chikira, Makoto
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 4
• Pages of publication: 447 - 454
• a: 9.897 ± 0.001 Å
• b: 11.233 ± 0.002 Å
• c: 11.851 ± 0.002 Å
• α: 65.609 ± 0.002°
• β: 70.409 ± 0.002°
• γ: 73.771 ± 0.002°
• Cell volume: 1115.1 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0313
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No