ADDITION OF CYCLOHEXYLISOTHIOCYANATE TO O,O-DIETHYL-N,N'-ETHYLENE-BIS-PHENYL METHYL PHOSPHONATE - X-RAY STRUCTURE OF THE CONDENSATION PRODUCT

Citation
S. Failla et al., ADDITION OF CYCLOHEXYLISOTHIOCYANATE TO O,O-DIETHYL-N,N'-ETHYLENE-BIS-PHENYL METHYL PHOSPHONATE - X-RAY STRUCTURE OF THE CONDENSATION PRODUCT, Phosphorus, sulfur and silicon and the related elements, 122, 1997, pp. 237-246
Citations number
8
ISSN journal
10426507
Volume
122
Year of publication
1997
Pages
237 - 246
Database
ISI
SICI code
1042-6507(1997)122:<237:AOCTO>2.0.ZU;2-J
Abstract
The synthesis and the molecular structure of the title compound has be en determined by single crystal X-ray analysis. C38H60N4O6P2S2 has a m eso configuration, its crystal is monoclinic space group P2(1)/c with a = 11.656(2), b = 18.480(4), c = 10.210(2), alpha = gamma = 90 degree s, beta = 94.91(3)degrees and Z = 2. The refinement had a R-value 0.05 37 for 2045 reflections. Bond distances and angles are quite normal an d were within the expected range for all of the atoms. The torsion ang le, N1-C8-C8A-N1A, is 180 degrees so the molecule takes on a rather la yered structure form one half to the other. There are a number of weak intermolecular interactions, but the strongest is between S1 and the hydrogens in C18 of the nearest neighbour molecule.