Information card for entry 7714953

Structure parameters

• Formula: C30 H42 N4 O4
• Calculated formula: C30 H42 N4 O4
• Title of publication: First 4,7-oxygenated 1,10-phenanthroline-2,9-diamides: synthesis, tautomerism and complexation with REE nitrates.
• Authors of publication: Avagyan, Nane A.; Lemport, Pavel S.; Roznyatovsky, Vitaly A.; Averin, Alexei D.; Yakushev, Alexei A.; Lyssenko, Konstantin A.; Perfilyev, Pavel D.; Isakovskaya, Ksenia L.; Aksenova, Svetlana A.; Nelyubina, Yulia V.; Vokuev, Mikhail F.; Rodin, Igor A.; Gloriozov, Igor P.; Ustynyuk, Yuri A.; Nenajdenko, Valentine G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 3052 - 3064
• a: 14.0169 ± 0.0005 Å
• b: 16.3104 ± 0.0006 Å
• c: 16.328 ± 0.0006 Å
• α: 94.93 ± 0.002°
• β: 103.562 ± 0.002°
• γ: 109.844 ± 0.002°
• Cell volume: 3357 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1312
• Residual factor for significantly intense reflections: 0.0708
• Weighted residual factors for significantly intense reflections: 0.1776
• Weighted residual factors for all reflections included in the refinement: 0.2256
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No