These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
177 related articles for article (PubMed ID: 35991613)
1. Unexpected kinetically controlled organoselenium-based isomaleimide: X-ray structure, hirshfeld surface analysis, 3D energy framework approach, and density functional theory calculation. Shaaban S; Ferjani H; Abd El-Lateef HM; Khalaf MM; Gouda M; Alaasar M; Yousef TA Front Chem; 2022; 10():961787. PubMed ID: 35991613 [TBL] [Abstract][Full Text] [Related]
2. A Competition between Hydrogen, Stacking, and Halogen Bonding in Gouda M; Ferjani H; Abd El-Lateef HM; Khalaf MM; Shaaban S; Yousef TA Int J Mol Sci; 2022 Feb; 23(5):. PubMed ID: 35269858 [No Abstract] [Full Text] [Related]
3. Syntheses, crystal structure, Hirshfeld surfaces, fluorescence properties, and DFT analysis of benzoic acid hydrazone Schiff bases. Alam MS; Lee DU Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jun; 145():563-574. PubMed ID: 25804368 [TBL] [Abstract][Full Text] [Related]
4. Synthesis, crystal structure, Hirshfeld surface analysis, energy frameworks and computational studies of Schiff base derivative. Chandini KM; Nagesh Khadri MJ; Amoghavarsha N; Sridhar MA; Khanum SA Heliyon; 2022 Aug; 8(8):e10047. PubMed ID: 36061005 [TBL] [Abstract][Full Text] [Related]
5. Facile synthesis, crystal structure, biological evaluation, and molecular modeling studies of Saeed A; Ejaz SA; Khalid A; Channar PA; Aziz M; Wani TA; Zargar S; Hassan S; Ismail H; Khalid D; Hashmi MZ; Hökelek T; Aborode AT Front Chem; 2022; 10():992701. PubMed ID: 36226116 [TBL] [Abstract][Full Text] [Related]
6. Quantum-chemical insight into structure-reactivity relationship in 4,5,6,7-tetrahalogeno-1H-benzimidazoles: a combined X-ray, DSC, DFT/QTAIM, Hirshfeld surface-based, and molecular docking approach. Latosińska JN; Latosińska M; Maurin JK; Orzeszko A; Kazimierczuk Z J Phys Chem A; 2014 Mar; 118(11):2089-106. PubMed ID: 24597713 [TBL] [Abstract][Full Text] [Related]
7. Crystal structure and vibrational spectra of Aslantatar E; Sharma SK; Villanueva O; Macbeth CE; Gümüş İ; Arslan H Turk J Chem; 2021; 45(6):1933-1951. PubMed ID: 38144579 [TBL] [Abstract][Full Text] [Related]
8. Role of hydrogen bonds and weak non-covalent interactions in the supramolecular assembly of 9-hydroxyeucaliptol: crystal structure, Hirshfeld surface analysis, and DFT calculations. Galvez CE; Rocha M; Villecco MB; Echeverría GA; Piro OE; Loandos MDH; Gil DM J Mol Model; 2021 Jan; 27(1):13. PubMed ID: 33403477 [TBL] [Abstract][Full Text] [Related]
9. A detailed exploration of intermolecular interactions in 4-(4-dimethylaminobenzylideneamino)-N-(5-methyl-3-isoxazolyl)benzenesulfonamide and related Schiff bases: Crystal structure, spectral studies, DFT methods, Pixel energies and Hirshfeld surface analysis. Gil DM; Salomón FF; Echeverría GA; Piro OE; Pérez H; Altabef AB Spectrochim Acta A Mol Biomol Spectrosc; 2017 Oct; 185():286-297. PubMed ID: 28595154 [TBL] [Abstract][Full Text] [Related]
10. Synthesis, crystal structure, Hirshfeld surface analysis, DFT, molecular docking and molecular dynamic simulation studies of (E)-2,6-bis(4-chlorophenyl)-3-methyl-4-(2-(2,4,6-trichlorophenyl)hydrazono)piperidine derivatives. Anthony LA; Rajaraman D; Sundararajan G; Suresh M; Nethaji P; Jaganathan R; Poomani K J Mol Struct; 2022 Oct; 1266():133483. PubMed ID: 35692554 [TBL] [Abstract][Full Text] [Related]
11. Integrated Structural, Functional, and ADMET Analysis of 2-Methoxy-4,6-diphenylnicotinonitrile: The Convergence of X-ray Diffraction, Molecular Docking, Dynamic Simulations, and Advanced Computational Insights. Bakheit AH; Alkahtani HM Molecules; 2023 Sep; 28(19):. PubMed ID: 37836701 [TBL] [Abstract][Full Text] [Related]
12. Synthesis, experimental and in silico studies of N-fluorenylmethoxycarbonyl-O-tert-butyl-N-methyltyrosine, coupled with CSD data: a survey of interactions in the crystal structures of Fmoc-amino acids. Bojarska J; Remko M; Madura ID; Kaczmarek K; Zabrocki J; Wolf WM Acta Crystallogr C Struct Chem; 2020 Apr; 76(Pt 4):328-345. PubMed ID: 32229714 [TBL] [Abstract][Full Text] [Related]
13. Intermolecular interactions, charge-density distribution and the electrostatic properties of pyrazinamide anti-TB drug molecule: an experimental and theoretical charge-density study. Rajalakshmi G; Hathwar VR; Kumaradhas P Acta Crystallogr B Struct Sci Cryst Eng Mater; 2014 Jun; 70(Pt 3):568-79. PubMed ID: 24892603 [TBL] [Abstract][Full Text] [Related]
14. Unexpected synthesis of novel 2-pyrone derivatives: crystal structures, Hirshfeld surface analysis and computational studies. Sebhaoui J; El Bakri Y; Lai CH; Karthikeyan S; Anouar EH; Mague JT; Essassi EM J Biomol Struct Dyn; 2021 Aug; 39(13):4859-4877. PubMed ID: 32571166 [TBL] [Abstract][Full Text] [Related]
15. Crystal structure, DFT studies, Hirshfeld surface and energy framework analysis of 4-(5-nitro-thiophen-2-yl)-pyrrolo [1, 2-a] quinoxaline: A potential SARS-CoV-2 main protease inhibitor. Divya KM; Savitha DP; Krishna GA; Dhanya TM; Mohanan PV J Mol Struct; 2022 Mar; 1251():131932. PubMed ID: 36536784 [TBL] [Abstract][Full Text] [Related]
16. Synthesis, crystal structure, spectroscopic and density functional theory (DFT) study of N-[3-anthracen-9-yl-1-(4-bromo-phenyl)-allylidene]-N-benzenesulfonohydrazine. Arshad MN; Asiri AM; Alamry KA; Mahmood T; Gilani MA; Ayub K; Birinji AS Spectrochim Acta A Mol Biomol Spectrosc; 2015 May; 142():364-74. PubMed ID: 25721652 [TBL] [Abstract][Full Text] [Related]
17. Polymorphs of Substituted Riaz M; Ali A; Ashfaq M; Ibrahim M; Akram N; Tahir MN; Kuznetsov A; Rodríguez L; Sameeh MY; Assiri MA; Torre AF ACS Omega; 2023 Sep; 8(38):35307-35320. PubMed ID: 37779999 [TBL] [Abstract][Full Text] [Related]
18. New tetrahedral zinc halide Schiff base complexes: Synthesis, crystal structure, theoretical, 3D Hirshfeld surface analyses, antimicrobial and thermal studies. Taghizadeh L; Montazerozohori M; Masoudiasl A; Joohari S; White JM Mater Sci Eng C Mater Biol Appl; 2017 Aug; 77():229-244. PubMed ID: 28532025 [TBL] [Abstract][Full Text] [Related]
19. Synthesis, Experimental and Theoretical Study of Azidochromones. Narváez-Ordoñez EG; Pabón-Carcelén KA; Zurita-Saltos DA; Bonilla-Valladares PM; Yánez-Darquea TG; Ramos-Guerrero LA; Ulic SE; Jios JL; Echeverría GA; Piro OE; Langer P; Alcívar-León CD; Heredia-Moya J Molecules; 2022 Apr; 27(9):. PubMed ID: 35565987 [TBL] [Abstract][Full Text] [Related]
20. A Dual Approach on Experimental, Theoretical Insight of Structural Elucidation, Hirshfeld Surface Analysis, Optical and Electrochemical Properties of Acyl Thiourea-Ethynyl Hybrid Derivatives. Daud AI; Khairul WM; Arshad S; Razak IA; González DLN; Erben MF J Chem Crystallogr; 2022; 52(3):345-358. PubMed ID: 35291441 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]