New Cobalt(II) and Copper(II) Thiocyanate Complexes of 2,5‐Bis(pyridin‐2‐yl)‐1,3,4‐oxadiazole Ligand: Synthesis, Crystal Structures, Spectral Properties and Hirshfeld Surface Analysis

Ferdaousse Rhoufal; Abdelhakim Laachir; Salaheddine Guesmi; Laurent Jouffret; Nicolas Sergent; Saïd Obbade; Mehmet Akkurt; Fouad Bentiss

doi:10.1002/slct.201901219

New Cobalt(II) and Copper(II) Thiocyanate Complexes of 2,5‐Bis(pyridin‐2‐yl)‐1,3,4‐oxadiazole Ligand: Synthesis, Crystal Structures, Spectral Properties and Hirshfeld Surface Analysis

ChemistrySelect ◽

10.1002/slct.201901219 ◽

2019 ◽

Vol 4 (26) ◽

pp. 7773-7783 ◽

Cited By ~ 3

Author(s):

Ferdaousse Rhoufal ◽

Abdelhakim Laachir ◽

Salaheddine Guesmi ◽

Laurent Jouffret ◽

Nicolas Sergent ◽

...

Keyword(s):

Crystal Structures ◽

Surface Analysis ◽

Spectral Properties ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Thiocyanate Complexes ◽

Ligand Synthesis

gem-Dibromovinyl boron dipyrrins: synthesis, spectral properties and crystal structures

Dalton Transactions ◽

10.1039/c9dt02309g ◽

2019 ◽

Vol 48 (30) ◽

pp. 11492-11507

Author(s):

Hasrat Ali ◽

Brigitte Guérin ◽

Johan E. van Lier

Keyword(s):

Crystal Structures ◽

Surface Analysis ◽

Spectral Properties ◽

Hirshfeld Surface ◽

Molecular Structures ◽

Hirshfeld Surface Analysis ◽

X Ray ◽

X Ray Crystallography

New asymmetric/symmetric BODIPY derivatives, bearing gem-dibromovinyl substituents were synthesized and studied for their absorption, fluorescence, solvatochromism, X-ray crystallography and Hirshfeld surface analysis to determine molecular structures.

Molecular salts of 2,6-dihydroxybenzoic acid (2,6-DHB) with N-heterocycles: Crystal structures, spectral properties and Hirshfeld surface analysis

Journal of Molecular Structure ◽

10.1016/j.molstruc.2016.12.055 ◽

2017 ◽

Vol 1134 ◽

pp. 190-198 ◽

Cited By ~ 4

Author(s):

K. Anand Solomon ◽

Olivier Blacque ◽

Ramanathan Venkatnarayan

Keyword(s):

Crystal Structures ◽

Surface Analysis ◽

Spectral Properties ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Dihydroxybenzoic Acid ◽

Molecular Salts

Two new copper (II) carboxylate complexes based on N,N,N',N'-tetramethylethyleneamine: Synthesis, crystal structures, spectral properties, dft studies and hirshfeld surface analysis

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.129916 ◽

2021 ◽

Vol 1230 ◽

pp. 129916

Author(s):

Sevgi Kansız ◽

Adnan M. Qadir ◽

Necmi Dege ◽

Serajul Haque Faizi

Keyword(s):

Crystal Structures ◽

Surface Analysis ◽

Spectral Properties ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Dft Studies ◽

Carboxylate Complexes

Synthesis, Crystal Structures, Hirshfeld Surface Analysis, and Magnetic Properties of Two Cu/Ni Schiff‐Base Complexes

Journal of Cluster Science ◽

10.1007/s10876-021-02081-w ◽

2021 ◽

Author(s):

Fayun Chen ◽

Haiyang Zhang ◽

Guangzhao Li ◽

Shuhua Zhang

Keyword(s):

Magnetic Properties ◽

Schiff Base ◽

Crystal Structures ◽

Surface Analysis ◽

Hirshfeld Surface ◽

Schiff Base Complexes ◽

Hirshfeld Surface Analysis

α-Aminophosphonates 4-XC6H4–NH–CH(4-BrC6H4)–P(O)(OiPr)2 (X = H, Br, MeO): Crystal structures, Hirshfeld surface analysis, computational studies and in silico molecular docking with the SARS-CoV-2 proteins

Tetrahedron ◽

10.1016/j.tet.2021.132376 ◽

2021 ◽

pp. 132376

Author(s):

Larisa E. Alkhimova ◽

Maria G. Babashkina ◽

Damir A. Safin

Keyword(s):

Molecular Docking ◽

Crystal Structures ◽

Surface Analysis ◽

In Silico ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Computational Studies ◽

In Silico Molecular Docking

A new complex of Zinc (II) with sulfamethoxazole ligand: Synthesis, crystal structure, Hirshfeld surface analysis, thermal properties, DFT calculations and antibacterial/antifungal activities

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.130903 ◽

2021 ◽

pp. 130903

Author(s):

Imane Habila ◽

Mouna Saoudi ◽

Fadila Berrah ◽

Belkacem Benmerad ◽

Mhamed Boudraa ◽

...

Keyword(s):

Crystal Structure ◽

Thermal Properties ◽

Dft Calculations ◽

Surface Analysis ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Antifungal Activities ◽

Ligand Synthesis

Phenylacetic acid co-crystals with acridine, caffeine, isonicotinamide and nicotinamide: Crystal structures, thermal analysis, FTIR spectroscopy and Hirshfeld surface analysis

Journal of Molecular Structure ◽

10.1016/j.molstruc.2017.02.066 ◽

2017 ◽

Vol 1139 ◽

pp. 60-66 ◽

Cited By ~ 5

Author(s):

Francoise M. Amombo Noa ◽

Ayesha Jacobs

Keyword(s):

Thermal Analysis ◽

Ftir Spectroscopy ◽

Crystal Structures ◽

Surface Analysis ◽

Phenylacetic Acid ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis

Synthesis, crystal structures, Hirshfeld surface analysis, theoretical insight and molecular docking studies of dinuclear and triply bridged Cu(II) carboxylate complexes with 2,2’-bipyridine or 1,10-phenanthroline

Polyhedron ◽

10.1016/j.poly.2021.115502 ◽

2021 ◽

pp. 115502

Author(s):

Abiodun A. Ajibola ◽

Kyle A. Grice ◽

Fouzia Perveen ◽

Agnieszka Wojciechowska ◽

Lesław Sieroń ◽

...

Keyword(s):

Molecular Docking ◽

Crystal Structures ◽

Surface Analysis ◽

Docking Studies ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Carboxylate Complexes ◽

Molecular Docking Studies ◽

Theoretical Insight

Electronic aspects of hydrogen bond patterns of P=O···H in crystal structures of phosphoramido acid derivatives: QSAR study of anti-urease activity, Hirshfeld surface analysis, and DFT calculations

Journal of the Iranian Chemical Society ◽

10.1007/s13738-020-01862-w ◽

2020 ◽

Vol 17 (6) ◽

pp. 1387-1400

Author(s):

Lida Asadi ◽

Khodayar Gholivand ◽

Karim Zare

Keyword(s):

Hydrogen Bond ◽

Dft Calculations ◽

Crystal Structures ◽

Surface Analysis ◽

Urease Activity ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Qsar Study ◽

Hydrogen Bond Patterns

Crystal structures, Hirshfeld surface analysis and PIXEL calculations of four (E)-1-(2-hydroxyphenyl)-3-phenylprop-2-en-1-one derivatives, containing methoxy substituents. The importance of π interactions

Journal of Molecular Structure ◽

10.1016/j.molstruc.2020.128652 ◽

2020 ◽

Vol 1221 ◽

pp. 128652

Author(s):

Ligia R. Gomes ◽

John N. Low ◽

Alan B. Turner ◽

James L. Wardell ◽

Alessandra C. Pinheiro

Keyword(s):

Crystal Structures ◽

Surface Analysis ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Π Interactions