Information card for entry 7244663

Structure parameters

• Chemical name: Dichloro{N1,N1-dimethyl-N2-[(1R,2S,3R,4S)-2-oxy-1,7,7- trimethylbicyclo[2.2.1]heptane -3-yl]ethane-1,2-diamine-N1,N2,O}copper(II)
• Formula: C14 H28 Cl2 Cu N2 O
• Calculated formula: C14 H28 Cl2 Cu N2 O
• SMILES: [Cu]12(Cl)(Cl)[N](C)(CC[NH]1[C@H]1[C@@H]([OH]2)[C@]2(C(C)([C@@H]1CC2)C)C)C
• Title of publication: Copper(ii) complexes with terpene derivatives of ethylenediamine: synthesis, and antibacterial, antifungal and antioxidant activity
• Authors of publication: Gur'eva, Yana A.; Zalevskaya, Olga A.; Shevchenko, Oksana G.; Slepukhin, Pavel A.; Makarov, Vadim A.; Kuchin, Aleksandr V.
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 15
• Pages of publication: 8841 - 8851
• a: 7.1957 ± 0.001 Å
• b: 12.0448 ± 0.0013 Å
• c: 10.685 ± 0.002 Å
• α: 90°
• β: 101.652 ± 0.015°
• γ: 90°
• Cell volume: 907 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1501
• Residual factor for significantly intense reflections: 0.0985
• Weighted residual factors for significantly intense reflections: 0.2429
• Weighted residual factors for all reflections included in the refinement: 0.3056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No