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Crystal structure of [bis-(2,6-diiso-propyl-phen-yl) phosphato-?O]tris-(methanol-?O)lithium methanol monosolvate.


ABSTRACT: Crystals of the title compound, [Li{OOP(O-2,6-(i)Pr2C6H3)2}(CH3OH)3]·CH3OH or [Li(C24H34O4P)(CH3OH)3]·CH3OH, have been formed in the reaction between HOOP(O-2,6-(i)Pr2C6H3)2 and LiOH in methanol. The title compound is of inter-est as it represents the first reported crystal structure of the family of lithium phosphate diesters. The {Li(CH3OH)3[O2P(O-(i)Pr2C6H3)2]} unit displays the Li atom in a slightly distorted tetra-hedral coordination environment and exhibits one intra-molecular O-H?O hydrogen bond between a coordinating methanol mol-ecule and the terminal non-coordinating O atom of the phosphate group. The unit is connected with two non-coordinating methanol mol-ecules through two inter-molecular O-H?O hydrogen bonds, and with a neighbouring unit through two other O-H?O inter-actions. These inter-molecular hydrogen bonds lead to the formation of infinite chains along [100]. There are no significant inter-actions between the chains.

SUBMITTER: Minyaev ME 

PROVIDER: S-EPMC4420106 | biostudies-literature | 2015 May

REPOSITORIES: biostudies-literature

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Crystal structure of [bis-(2,6-diiso-propyl-phen-yl) phosphato-κO]tris-(methanol-κO)lithium methanol monosolvate.

Minyaev Mikhail E ME   Nifant'ev Ilya E IE   Tavtorkin Alexander N AN   Korchagina Sof'ya A SA   Zeynalova Shadana Sh SSh  

Acta crystallographica. Section E, Crystallographic communications 20150402 Pt 5


Crystals of the title compound, [Li{OOP(O-2,6-(i)Pr2C6H3)2}(CH3OH)3]·CH3OH or [Li(C24H34O4P)(CH3OH)3]·CH3OH, have been formed in the reaction between HOOP(O-2,6-(i)Pr2C6H3)2 and LiOH in methanol. The title compound is of inter-est as it represents the first reported crystal structure of the family of lithium phosphate diesters. The {Li(CH3OH)3[O2P(O-(i)Pr2C6H3)2]} unit displays the Li atom in a slightly distorted tetra-hedral coordination environment and exhibits one intra-molecular O-H⋯O hydrog  ...[more]

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