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Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and 15N NMR study†
Mehrdad Pourayoubi,Maryam Toghraee,Jianfeng Zhu,Michal Dušek,Pablo J. Bereciartua,Václav Eigner
CrystEngComm Pub Date : 10/08/2014 00:00:00 , DOI:10.1039/C4CE01793E
Abstract

We present the synthesis and characterization of seven new phosphoric triamides followed by analysis of hydrogen bond patterns of the new compounds as well as the phosphoric triamides found in the Cambridge Structural Database (CSD). The analysis of hydrogen bond patterns updates the previous work (Toghraee, Pourayoubi and Divjakovic in Polyhedron, 2011, 30, 1680) on phosphoric triamides with a C(O)NHP(O)[N]2 skeleton, and extends the analysis to other phosphoric triamides i.e. ones without a C[double bond, length as m-dash]O attached to the N of N–P[double bond, length as m-dash]O. For the new phosphoric triamides we also investigated their spectroscopic features (31P, 1H, 13C, and 15N NMR, mass spectroscopy, IR spectroscopy), measured the 1J(15N,31P) coupling constants and discussed the effective parameters.

Graphical abstract: Database analysis of hydrogen bond patterns in phosphoric triamides completed with seven new compounds: a crystallographic and 15N NMR study
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