Results 171 to 180 of about 1,771,283 (231)

Utilizing Hirshfeld surface calculations, non-covalent interaction (NCI) plots and the calculation of interaction energies in the analysis of molecular packing [PDF]

, 2019
Sang Loon Tan, Mukesh M. Jotani, Edward R. T. Tiekink   +2 more
openalex   +1 more source

SYNTHESIS, CRYSTAL STRUCTURE AND HIRSHFELD SURFACE ANALYSIS OF 1-ACETYL-5-(2-METHYLPROPYL)-2-THIOXO-IMIDAZOLIDIN- 4-ONE

, 2018
Cecilia Chacón, José Antonio Henao, Joazaizulfazli Jamalis, Pedro Rivas, William Velásquez, Gerzón E. Delgado   +5 more
openalex   +1 more source

Synthesis, crystal structures, Hirshfeld surface analysis and spectroscopic studies of two Schiff bases of anisaldehyde and their urease and acetylcholinesterase inhibitory and antioxidant properties [PDF]

, 2019
Amber Jan Muhammad, Dildar Ahmed, Sammer Yousuf, Nida Tabassum, Muhammad Tahir ul Qamar   +4 more
openalex   +1 more source

The crystal structures and Hirshfeld surface analysis of N′,N′′′-((1E,1′E)-{[methylenebis(oxy)]bis(6-bromo-3,1-phenylene)}bis(methanylylidene))bis(isonicotinohydrazide) dihydrate and N′,N′′′-((1E,1′E)-{[butane-1,4-diylbis(oxy)]bis(2,1-phenylene)}bis(methanylylidene))bis(isonicotinohydrazide) [+ solvent] [PDF]

, 2019
S. Syed Abuthahir, M. NizamMohideen, V. Viswanathan, Tamilselvan Abiraman, S. Balasubramanian   +4 more
openalex   +1 more source

Crystal structure and Hirshfeld surface analysis of lapachol acetate 80 years after its first synthesis [PDF]

, 2019
Miguel A. Martínez-Cabrera, Mario A. Macías, Francisco Ferreira, Enrique Pandolfi, Javier E. Barúa, Leopoldo Suescun   +5 more
openalex   +1 more source

Crystal structure and Hirshfeld surface analysis of poly[tris(μ4-benzene-1,4-dicarboxylato)tetrakis(dimethylformamide)trinickel(II)]: a two-dimensional coordination network [PDF]

, 2019
Cesario Ajpi, Leopoldo Suescun, Naviana Leiva, Anders Lundblad, Göran Lindbergh, Saúl Cabrera   +5 more
openalex   +1 more source

Synthesis, Vibrational Spectroscopy, Crystal Structure and Hirshfeld Surface Analysis of Sodium Aquadichlororido[N-(3-aminopropyl)-N′-(propyl)ethane-1,2-diamine]chromium(III) Tetrachloridozincate

, 2018
Dohyun Moon, Jong‐Ha Choi
openalex   +1 more source

Synthesis, Crystal Structure, Hirshfeld Surface, Energy Framework and Molecular Docking Analysis of Two Novel Carbazole Derivatives

, 2019
G. Dhanalakshmi, Velu Saravanan, Arasambattu K. Mohanakrishnan, S. Aravindhan   +3 more
openalex   +1 more source

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Hirshfeld surface analysis

, 2009
In the last few years the analysis of molecular crystal structures using tools based on Hirshfeld surfaces has rapidly gained in popularity. This approach represents an attempt to venture beyond the current paradigm—internuclear distances and angles ...
M. Spackman, D. Jayatilaka
semanticscholar   +1 more source

Synthesis, Characterisation and Hirshfeld surface analysis of some Mercury(II) molecular adducts with macrocyclic ligands

Research journal of chemistry and environment, 2023
Fifteen complexes of Hg(II) of the type [HgX2.L1-5] with macrocyclic ligands derived from 9,10-phenanthren-quinone and different aliphatic diamines NH2(CH2)nNH2 (where n = 2 or 3 or 4 or 5 or 6) have been synthesised and characterised by elemental ...
Mukta Singh, Rahul Kanaoujiya, S. Srivastava   +2 more
semanticscholar   +1 more source