17th Iranian Inorganic Chemistry Conference , 2015-09-03

Title : ( Synthesis and characterization of some new phosphoramide and thiophosphoramide derivatives: crystal structure of CHCl2C(O)NHP(O)[NHCH2CH2CH3]2 )

Authors: Mehrdad Pourayoubi , EHTRAM MOHAMDI , mohammad abad , Marek Nečas ,

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Abstract

A new phosphoric triamide structure, CHCl2C(O)NHP(O)[NHCH2CH2CH3]2 (i), is investigated. The P atom is within an [NCP]P(O)[N]2 environment (NCP is the nitrogen atom of the C(O)NHP(O) segment) with the bond angles at the P atom in the range of 103.46(9) to 118.51(9)°. The NCP―H bond adopts a syn conformation with respect to the P═O group, whereas, the two other N―H units are in an anti conformation with respect to the P═O group. As it is expected and observed for analogous structures,1 the P―NCP bond length (of 1.6962(16) Å) is longer than the two other P―N bonds (1.6201(16) and 1.6257(18) Å). In the crystal structure, molecules are aggregated in a one-dimensional arrangement parallel to the plane (1–10) in the direction perpendicular to the (110) plane (Fig. 1). The spectroscopic features of the title structure as well as some phosphoramides ([2-Cl-C6H4O]P(O)[NHCH2C6H4-4-Cl]2 (ii), [2-Cl-C6H4O]P(O)[NHCH2C6H4-4-CH3]2 (iii), [4-Cl-C6H4CH2NH]3P(O) (iv))and thiophosphoramides ([4-Cl-C6H4CH2NH]3P(S) (v), [4-CH3-C6H4CH2NH]3P(S) (vi), [CH3O]2P(S)[NHCH2C6H4-4-CH3]2 (vii)) are reported. Fig. 1. A view of the crystal packing of CHCl2C(O)NHP(O)[NHCH2CH2CH3]2 is represented. The carbon-bound H atoms were omitted for the sake of clarity and the hydrogen bonds are shown as dotted lines. References 1 M. Toghraee, M. Pourayoubi, V. Divjakovic, Polyhedron, 2011, 30, 1680–1690.

Keywords

, Phosphoramide, Thiophosphoramide, Crystal structure
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@inproceedings{paperid:1050456,
author = {Pourayoubi, Mehrdad and MOHAMDI, EHTRAM and Abad, Mohammad and Marek Nečas},
title = {Synthesis and characterization of some new phosphoramide and thiophosphoramide derivatives: crystal structure of CHCl2C(O)NHP(O)[NHCH2CH2CH3]2},
booktitle = {17th Iranian Inorganic Chemistry Conference},
year = {2015},
location = {تبریز, IRAN},
keywords = {Phosphoramide; Thiophosphoramide; Crystal structure},
}

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%0 Conference Proceedings
%T Synthesis and characterization of some new phosphoramide and thiophosphoramide derivatives: crystal structure of CHCl2C(O)NHP(O)[NHCH2CH2CH3]2
%A Pourayoubi, Mehrdad
%A MOHAMDI, EHTRAM
%A Abad, Mohammad
%A Marek Nečas
%J 17th Iranian Inorganic Chemistry Conference
%D 2015

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