Results 1 to 10 of about 4,722,216 (249)

Synthesis, crystal structure and Hirshfeld surface analysis of 2-(perfluorophenyl)acetamide in comparison with some related compounds

Acta Crystallographica Section E: Crystallographic Communications, 2022
The molecular and crystal structures of the title compound, C8H4F5NO, were examined by single-crystal X-ray diffraction and Hirshfeld surface analysis. The title compound was synthesized by a new method at the interface of aqueous solutions of LiOH and ...
Anton P. Novikov, Alexey A. Bezdomnikov, Mikhail S. Grigoriev, Konstantin E. German   +3 more
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Crystal structure and Hirshfeld surface analysis of 5-bromo-1,3,4-thia-diazol-2-amine. [PDF]

Acta Crystallogr E Crystallogr Commun
In the crystal of the title compound, C2H2BrN3S, N—H...N hydrogen bonds connect the molecules in the form of hydrogen-bonded double-layered ribbons along the c-axis direction including R22(8) and R21(3) motifs, which extend to double layers in the bc ...
Torambetov B, Djiemuratov M, Rasulov A, Akkurt M, Manahelohe GM, Hasanov KI, Jamalov PJ.   +6 more
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Integrated Experimental and Computational Investigation of Fluorinated Benzoylthiourea Derivatives: Structural Characterization, Hirshfeld Surface Analysis, Antioxidant Activity, and MAO–B Inhibitory Potential for Parkinson’s Disease [PDF]

ACS Omega
Gul L, Solmaz U, Arslan H.
europepmc   +2 more sources

Crystal structure and Hirshfeld surface of 5-bromo­salicylic acid di­methyl­formamide mono­solvate [PDF]

Acta Crystallographica Section E: Crystallographic Communications
Akerele O, Lemmerer A.
europepmc   +3 more sources

Crystal structure and Hirshfeld surface analysis of 2,5-dimethyl-1H-benzo[d]imidazole [PDF]

Acta Crystallographica Section E: Crystallographic Communications
Oulhaj A, Sebhaoui J, Al Ati G, Al-Ostoot F, Mague J, Essassi E, Duong A, Chkirate K.   +7 more
europepmc   +3 more sources

Crystal structure and Hirshfeld surface analysis of 1,2-bis­[5-(4-fluoro­phen­yl)-1,3-oxazol-2-yl]benzene [PDF]

Acta Crystallographica Section E: Crystallographic Communications
Dyakonenko V, Shaposhnyk A, Iliashenko R, Doroshenko A, Kyrychenko A.   +4 more
europepmc   +2 more sources

Single crystal X-ray structural and Hirshfeld surface analysis dataset for some isobutyl-1,2,6-triaryl-4-(arylamino)-1,2,5,6-tetrahydropyridine-3-carboxylates

Data in Brief, 2021
This article reports the single-crystal X-ray diffraction dataset of some isobutyl-1,2,6-triaryl-4-(arylamino)-1,2,5,6-tetrahydropyridine-3-carboxylate (1-3) derivatives with Hirshfeld surface analysis.
Chandran Udhaya Kumar, Poyyamozhi Surendar Anand, Annamalai Sethukumar, Kuppusamy Krishnasamy, Sivakolunthu Senthan, Govindhasamy Manikandan, Balasubramaniam Arul Prakasam   +6 more
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Synthesis, crystal structure and Hirshfeld surface analysis of di-μ2-iodido-bis[(2,2′-biquinoline-κ2N,N′)copper(I)]

Acta Crystallographica Section E: Crystallographic Communications, 2023
The molecular and crystal structures of the title compound, [Cu2I2(C18H12N2)2], were examined by single-crystal X-ray diffraction and Hirshfeld surface analysis.
Ayalew W. Temesgen, Anton P. Novikov, Alexander G. Tskhovrebov, Ekaterina K. Kultyshkina, Tuan Anh Le   +4 more
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Synthesis, Crystal Structure, Hirshfeld Surface, Vibrational Thermal Analyses, and NLO Properties of a New Hybrid Material: 2,4-Diamino-6-Phenyl-1,3,5-Triazinium Perchlorate, Supported by DFT Calculations [PDF]

Molecules
Ouksel L, Kiche R, Boudjema L, Youcef H, Amrane A, Roisnel T, Bourzami R.   +6 more
europepmc   +2 more sources

Crystal structure and Hirshfeld surface analysis of 3-methyl-4-oxo-N-phenyl-3,4-dihydroquinazoline-2-carbothioamide

Acta Crystallographica Section E: Crystallographic Communications, 2022
The asymmetric unit of the title compound, C16H13N3OS, comprises two molecules (A and B) with similar conformations that differ mainly in the orientation of the phenyl group relative to the rest of the molecule, as expressed by the Cthioamide—Nthioamide ...
Nasiba Pirnazarova, Ubaydullo Yakubov, Sevara Allabergenova, Akmaljon Tojiboev, Kambarali Turgunov, Burkhon Elmuradov   +5 more
doaj   +1 more source