Results 161 to 170 of about 1,206,495 (293)

Design, synthesis, docking, Hirshfeld surface analysis and DFT calculations of 2-methylxanthen-9-with the FtsZ protein from Staphylococcus aureus [PDF]

, 2021
V. Lakshmi Ranganatha
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Crystal Structure, Spectral Studies, and Hirshfeld Surfaces Analysis of 5-Methyl-5H-dibenzo[b,f]azepine and 5-(4-Methylbenzyl)-5H-dibenzo[b,f]azepine [PDF]

, 2014
S. Madan Kumar, Basavapattana C. Manjunath, Koravangala S. Vinay Kumar, K.J. Pampa, Maralinganadoddi P. Sadashiva, Neartur Krishnappagowda Lokanath   +5 more
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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
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Syntheses, crystal structures and Hirshfeld surface analysis of 4-(4-nitrophenyl)piperazin-1-ium trifluoroacetate and 4-(4-nitrophenyl)piperazin-1-ium trichloroacetate [PDF]

, 2022
Holehundi J. Shankara Prasad, Devaraju, Subbaiah M. Murthy, H. Kaspiaruk, H.S. Yathirajan, Sabine Foro, Lilianna Chęcińska   +6 more
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Crystal Structure and Hirshfeld Surface Analysis of Hexakis(acetoxymethyl)benzene

Molbank
Representatives of the hexasubstituted benzene derivatives, also known as hexa-hosts, have been the subject of extensive studies in solution and in the solid state, including the investigation of their ability to act as artificial receptors for various substrates, as well as detailed conformational analyses. In this paper, we describe the X-ray crystal
Manuel Stapf, Wilhelm Seichter, Monika Mazik   +2 more
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Crystal structure and Hirshfeld surface analysis of (E)-1-{2,2-dibromo-1-[4-(tert-butyl)phenyl]ethenyl}-2-(3,4-dimethylphenyl)diazene

Acta Crystallographica Section E: Crystallographic Communications
The title azo compound, C20H22Br2N2, crystallizes in the triclinic space group P1 (No. 2) with two independent molecules in the asymmetric unit. The molecular structure was analyzed using spectroscopic and crystallographic techniques, confirming the ...
Namig G. Shikhaliyev, Jonathan Cisterna, Ayten M. Gajar, Ayten A. Niyazova, Ali N. Khalilov, Victor N. Khrustalev, Alebel N. Belay, Abel M. Maharramov   +7 more
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Crystal structure and Hirshfeld surface analysis of 3-[2-(3,5-dimethylphenyl)hydrazinylidene]benzofuran-2(3H)-one [PDF]

, 2021
Zeliha Atioğlu, Mehmet Akkurt, Namiq Q. Shikhaliyev, Ulviyya F. Askerova, Sevinc H. Mukhtarova, Rizvan K. Askerov, Ajaya Bhattarai   +6 more
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Crystal structure and Hirshfeld surface analysis of 3-[(E)-2-(2-bromo-4,5-dimethoxyphenyl)ethenyl]-5,5-dimethylcyclohex-2-en-1-one

Acta Crystallographica Section E: Crystallographic Communications
In the title compound, C18H21BrO3, which represents an isophorone (3,5,5-trimethyl-2-cyclohexen-1-one) derivative, the cyclohexene ring adopts a twist-boat conformation.
Muruganandham Rajkumar, Uthirapathi Rajapandiyan, Haridoss Manikandan, Velusamy Rajathi, Sivashanmugam Selvanayagam   +4 more
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2,2′:4,4′′:4′,4′′′-Quaterpyridine: synthesis, crystal-structure description, and Hirshfeld surface analysis [PDF]

, 2023
Stephen Opeyemi Aderinto, Jim A. Thomas, Craig C. Robertson   +2 more
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A Hirshfeld Surface Analysis and Crystal Structure of 2’-[1-(2-Fluoro-Phenyl)-1H-tetrazol-5-Yl]-4-Methoxy-Biphenyl-2-Carbaldehyde

, 2013
S. Madan Kumar, B. C. Manjunath, Gejjalagere S. Lingaraju, Muneer Abdoh, Maralinganadoddi P. Sadashiva, N.K. Lokanath   +5 more
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