Information card for entry 7014275

Structure parameters

• Formula: C268 H222 Cl10 N36 O32 U8
• Calculated formula: C268 H212 Cl10 N36 O32 U8
• SMILES: c1ccccn1.c1cccnc1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.[U]123456([N]7=Cc8c9[O]3[U]3%10(Oc%11c([O]23)c(ccc%11)C=[N]4Cc2c7cccc2)([O]1c1c(c(C=NCc2ccccc2N=Cc2c3O[U]47%11%12(Oc3ccc2)([N]2=Cc3c%13c(ccc3)O[U]3%14([O]7c7c(c(ccc7)C=NCc7ccccc7N=Cc7c(O5)c(O6)ccc7)O3)([O]%11%13)([O]%12c3c(C=[N]4c4c(C2)cccc4)cccc3O%14)(Cl)Cl)Cl)ccc1)O%10)(Oc9ccc8)(Cl)Cl)Cl.[U]123456([O]7[U]89%10(Oc%11c7c(ccc%11)C=[N]4Cc4ccccc4[N]5=Cc4c([O]18)c(O9)ccc4)(Cl)[O]6c1c(c(ccc1)C=NCc1ccccc1N=Cc1c4O[U]5678([O]9c%11c(c(ccc%11)C=NCc%11ccccc%11N=Cc%11c(O2)c(O3)ccc%11)O[U]23%119(Oc9c(c(ccc9)C=[N]5Cc5ccccc5[N]6=Cc5c([O]83)c(O%11)ccc5)[O]72)Cl)(Oc4ccc1)Cl)O%10)Cl.c1ccccn1.c1ccccn1.c1ccccn1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.n1ccccc1.c1ccccn1
• Title of publication: Synthesis and crystal structure of tetra- and hexanuclear uranium(IV) complexes with hexadentate compartmental Schiff-base ligands.
• Authors of publication: Salmon, Lionel; Thuéry, Pierre; Ephritikhine, Michel
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 24
• Pages of publication: 4139 - 4145
• a: 16.244 ± 0.002 Å
• b: 17.3019 ± 0.0018 Å
• c: 23.439 ± 0.002 Å
• α: 80.542 ± 0.005°
• β: 79.928 ± 0.005°
• γ: 72.362 ± 0.005°
• Cell volume: 6137.5 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2282
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.0888
• Weighted residual factors for all reflections included in the refinement: 0.1358
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No