Competing and directing interactions in new phosphoramide/thiophosphoramide structures: energy considerations and evidence for CH⋯HC contacts and aliphatic–aromatic stacking

Author:

Hosseinpoor Saeed1ORCID,Pourayoubi Mehrdad1ORCID,Abrishami Mozhgan2,Sobati Marjan2,Karimi Ahmadabad Fatemeh1ORCID,Sabbaghi Fahimeh3,Nečas Marek4,Dušek Michal5ORCID,Kučeráková Monika5,Kaur Manpreet6

Affiliation:

1. Department of Chemistry, Faculty of Science, Ferdowsi University of Mashhad, Mashhad, Iran

2. Department of Chemistry, Payame Noor University, 19395-4697 Tehran, Iran

3. Department of Chemistry, Zanjan Branch, Islamic Azad University, Zanjan, Iran

4. Department of Chemistry, Masaryk University, Kotlarska 2, Brno, 61137, Czech Republic

5. Institute of Physics of the Czech Academy of Sciences, Na Slovance 2, 182 21 Prague 8, Czech Republic

6. Department of Chemistry, Keene State College, Keene, NH, USA

Abstract

Structural analysis of a set of phosphoramide/thiophosphoramide derivatives by scrutinizing the energy and topological calculations discloses the role of individual interactions in crystal formation.

Funder

Ferdowsi University of Mashhad

Publisher

Royal Society of Chemistry (RSC)

Subject

Condensed Matter Physics,General Materials Science,General Chemistry

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