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Crystal and molecular structure of the solvate of 2,4,7-trinitro-9,9,10,10-tetrahydroxyphenanthrene with hexamethylphosphortriamide (I) and the solvate of 2,4,7-trinitro-10,10-dihydroxyphenanthren-9-one with dimethylformamide (II)
Authors:G V Gridunova  V E Shklover  Yu T Struchkov  R V Linko  A N Poplavskii  A M Andrievskii
Institution:(1) A. N. Nesmeyanov Institute of Heteroorganic Compounds, Academy of Sciences of the USSR, Moscow;(2) Scientific Research Institute for Organic Intermediates and Dyes, Moscow
Abstract:Two products of the addition reactions of H2O at the carbonyl bonds of 2,4,7-trinitro-9,10-phenanthrenequinone, formed under mild conditions when it is dissolved in aqueous hexamethylphosphortriamide (HMPTA) and dimethylformamide (DMF), have been studied by x-ray diffraction. The crystalline solvates of 2,4,7-trinitro-9,9,10,10-tetrahydroxyphenanthrene (C14H9N3O10·3HMPTA) and 2,4,7-trinitro-10,10-dihydroxyphenanthren-9-one (C14H7N3O9·2DMF) are formed. In the first of these, all the molecules of the included solvent are disordered in complex fashion. Both crystal structures are stabilized by strong hydrogen bonds between the solvated and solvating molecules.Translated from Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, No. 3, pp. 575–580, March, 1990.
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