Information card for entry 7226211

Structure parameters

• Formula: C21 H22 Cu N4 O7
• Calculated formula: C21 H22 Cu N4 O7
• SMILES: [Cu]12(OC(=O)[C@@H]([NH2]2)Cc2ccccc2)([n]2cccc3ccc4ccc[n]1c4c23)[OH2].O=N(=O)[O-].O
• Title of publication: Synthesis, characterization, crystal structure of RNA targeted L- and D-phenylalanine-(1, 10-phen)-copper(II) conjugate complexes; Comparative in vitro RNA binding profile of enantiomers and their biological evaluation by morphological studies and antibacterial activity
• Authors of publication: Sharma, Surbhi; Toupet, Loïc; Ahmad, Musheer; Arjmand, Farukh
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 5.7469 ± 0.0001 Å
• b: 20.6365 ± 0.0002 Å
• c: 9.2801 ± 0.0001 Å
• α: 90°
• β: 98.204 ± 0.001°
• γ: 90°
• Cell volume: 1089.32 ± 0.02 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0264
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.0775
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No