Structural and electronic aspects of hydrogen bonding in two polymorphs of butylene‐N,N′‐bis(O,O′‐diarylphosphoramidate)

The bisphosphoramidate (C6H5O)2P(O)NH(CH2)4NHP(O)(OC6H5)2 crystallizes in two polymorphs, one (ndl) with a needle habit from tetrahydrofuran (THF)/ethanol and another (prm) which forms prisms from H2O/ethanol. The molecules in the two forms differ from each other in some torsion angles and the orien...

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Veröffentlicht in:	Acta crystallographica Section B, Structural science, crystal engineering and materials Structural science, crystal engineering and materials, 2013-02, Vol.69 (1), p.55-61
Hauptverfasser:	Gholivand, Khodayar, Valmoozi, Ali A. Ebrahimi, Mahzouni, Hamid R.
Format:	Artikel
Sprache:	eng
Schlagworte:	Angles (geometry) bisphosphoramidate Bonding Crystal structure density‐functional theory calculations Electronics Ethanol Ethyl alcohol Hydrogen bonding Mathematical models polymorphism X‐ray crystallography
Online-Zugang:	Volltext
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