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Isomorphous rare-earth bis[bis(2,6-diisopropyl-phenyl)phosphate] complexes and their selfassembly into two-dimensional frameworks by intramolecular hydrogen bonds

Acta Crystallographica. Section C, Structural chemistry. 2017. Vol. 73. P. 820–827.
Миняев М., Нифантьев И., Тавторкин А., Корчагина С., Зейналова Ш., Ananyev I., Чураков А.

The crystal structures of rare-earth diaryl- or dialkylphosphate derivatives are poorly explored. Crystals of bis[bis(2,6-diisopropylphenyl) phosphato-kappa O] chloridotetrakis( methanol-kappa O) neodymium methanol disolvate, [Nd(C24H34O4P)Cl( CH4O)(4)]center dot 2CH(3)OH, (1), and of the lutetium, [Lu(C24H34O4P) Cl(CH4O)(4)]center dot-2CH(3)OH, (2), and yttrium, [Y(C24H34O4P) Cl(CH4O)(4)]center dot 2CH(3)OH,(3), analogues have been obtained by reactions between lithium bis(2,6-diisopropylphenyl)-phosphate and LnCl(3)(H2O)(6) (in a 2:1 ratio) in methanol. Compounds (1)-(3) crystallize in the C2/c space group. Their crystal structures are isomorphous. The molecule possesses C-2 symmetry with a twofold crystallographic axis passing through the Ln and Cl atoms. The bis(2,6-diisopropylphenyl) phosphate ligands all display a kappa O-1-monodentate coordination mode. The coordination polyhedron for the metal atom [coordination number (CN) = 7] is a distorted pentagonal bipyramid. Each [Ln{O2P(O-2,6-(Pr2C6H3)-Pr-i)(2)}(2)Cl(CH3OH)(4)] molecular unit exhibits two intramolecular O-H center dot center dot center dot O hydrogen bonds, forming six-membered rings, and two intramolecular O-H center dot center dot center dot Cl interactions, forming four-membered rings. Intermolecular O-H . . . O hydrogen bonds connect each unit via four noncoordinating methanol molecules with four other units, forming a two-dimensional hydrogen-bond network. Crystals of bis[bis(2,6-diisopropylphenyl) phosphato-kappa O] tetrakis(methanol-kappa O)(nitrato-kappa(2) O, O ') neodymium methanol disolvate, [Nd(C24H34O4P)(NO3)(CH4O)(4)]center dot 2CH(3)OH, (4), have been obtained in an analogous manner from NdCl3(H2O)(6). Compound (4) also crystalizes in the C2/c space group. Its crystal structure is similar to those of (1)-(3). The kappa(2) O, O '-bidentate nitrate anion is disordered over a twofold axis, being located nearly on it. Half of the molecule is crystallographically unique (CNNd = 8). Unlike (1)-(3), complex (4) exhibits disorder of all three methanol molecules, one isopropyl group of the phosphate ligand and the NO3- ligand. The structure of (4) displays intra- and intermolecular O-H center dot center dot center dot O hydrogen bonds similar to those in (1)-(3). Compounds (1)-(4) represent the first reported mononuclear bis[bis(diaryl/dialkyl) phosphate] rare-earth complexes.

Language: English
DOI
Keywords: isomorphismself-assemblyhydrogen bondingrare earth crystal structuretwo-dimensional frameworkdiarylphosphate
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