Information card for entry 7061076

Structure parameters

• Chemical name: Disodium tetrakis-[(N,N'-bis(dimethoxyphosphoryl)hexafluoroglutaramido)]- aqua-dineodymium(III) Dihydrate
• Formula: C36 H54 F24 N8 Na2 Nd2 O35 P8
• Calculated formula: C36 H48 F24 N8 Na2 Nd2 O35 P8
• Title of publication: Novel quadruple-stranded heterometallic Ln2Na complexes hosting sodium ions inside the cryptand-like cavity
• Authors of publication: Horniichuk, Oleksandr Ye.; Trush, Victor A.; Kariaka, Nataliia S.; Shishkina, Svitlana V.; Dyakonenko, Viktoriya V.; Severinovskaya, Olga V.; Gawryszewska, Paula; Domasevitch, Kostiantyn V.; Watras, Adam; Amirkhanov, Vladimir M.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 47
• Pages of publication: 22361 - 22368
• a: 12.1643 ± 0.0002 Å
• b: 12.6444 ± 0.0002 Å
• c: 14.1504 ± 0.0003 Å
• α: 105.257 ± 0.002°
• β: 104.052 ± 0.002°
• γ: 109.38 ± 0.001°
• Cell volume: 1845.88 ± 0.07 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1459
• Weighted residual factors for all reflections included in the refinement: 0.1491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No