Information card for entry 7240843

Structure parameters

• Chemical name: 1,10-phenantroline-4,7-dichloro-2,9-diylbis(piperidin-1-yl-methanone)
• Formula: C24 H26 Cl2 N4 O3
• Calculated formula: C24 H24 Cl2 N4 O3
• SMILES: Clc1cc(nc2c1ccc1c(Cl)cc(nc21)C(=O)N1CCCCC1)C(=O)N1CCCCC1.O
• Title of publication: The impact of alicyclic substituents on the extraction ability of new family of 1,10-phenanthroline-2,9-diamides
• Authors of publication: Lemport, Pavel S.; Matveev, Petr I.; Yatsenko, Alexander V.; Evsiunina, Mariia V.; Petrov, Valentine S.; Tarasevich, Boris N.; Roznyatovsky, Vitaly A.; Dorovatovskii, Pavel V.; Khrustalev, Victor N.; Zhokhov, Sergey S.; Solov'ev, Vitaly P.; Aslanov, Leonid A.; Petrov, Vladimir G.; Kalmykov, Stepan N.; Nenajdenko, Valentine G.; Ustyniuk, Yuri A.
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 44
• Pages of publication: 26022 - 26033
• a: 36.3267 ± 0.0015 Å
• b: 6.8415 ± 0.0002 Å
• c: 22.188 ± 0.0011 Å
• α: 90°
• β: 122.928 ± 0.003°
• γ: 90°
• Cell volume: 4628.5 ± 0.4 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0992
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 0.846
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No