Information card for entry 7244559

Structure parameters

• Formula: C26 H24 Cl4 Cu2 N6 O3 Se2
• Calculated formula: C26 H24 Cl4 Cu2 N6 O3 Se2
• SMILES: [Cu]1(Cl)(Cl)[n]2ccccc2C=C2[N]1=C([Se]CC[Se]C1=[N]3[Cu](Cl)(Cl)[n]4ccccc4C=C3C(=O)N1C1CC1)N(C2=O)C1CC1.O
• Title of publication: Copper coordination compounds with (5Z,5Z′)-2,2′-(alkane-α,ω-diyldiselenyl)-bis-5-(2-pyridylmethylene)-3,5-dihydro-4H-imidazol-4-ones. Comparison with sulfur analogue
• Authors of publication: Finko, Alexander V.; Sokolov, Anatolii I.; Guk, Dmitry A.; Tafeenko, Victor A.; Moiseeva, Anna A.; Skvortsov, Dmitry A.; Stomakhin, Andrei A.; Beloglazkin, Andrei A.; Borisov, Roman S.; Pergushov, Vladimir I.; Melnikov, Mikhail Ya.; Zyk, Nikolay V.; Majouga, Alexander G.; Beloglazkina, Elena K.
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 12
• Pages of publication: 7133 - 7148
• a: 10.0633 ± 0.0003 Å
• b: 28.064 ± 0.001 Å
• c: 11.2909 ± 0.0003 Å
• α: 90°
• β: 93.491 ± 0.002°
• γ: 90°
• Cell volume: 3182.82 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.1419
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1345
• Goodness-of-fit parameter for all reflections included in the refinement: 0.774
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No