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134 related items for PubMed ID: 30273694

  • 1. Crystal structures and Hirshfeld surface analyses of the di- and tri-hydrates of (5α,17E)-17-hydrazonoandrostan-3-ol: Significant differences in the hydrogen bonding patterns and supramolecular arrangements.
    Gomes LR, Low JN, Turner AB, Baddeley TC, Wardell JL.
    Steroids; 2018 Dec; 140():92-103. PubMed ID: 30273694
    [Abstract] [Full Text] [Related]

  • 2. Crystal structures and Hirshfeld surface analyses of the hemi-hydrate and hemi-methanolate of 3α-hydroxy-16α-bromoandrostan-17-one, 3: Differences in supramolecular arrangements.
    Gomes LR, Low JN, Turner AB, Wardell JL.
    Steroids; 2018 Sep; 137():30-39. PubMed ID: 30031854
    [Abstract] [Full Text] [Related]

  • 3. Crystal structures of 3β,19-dihydroxyandrost-5-en-17-one, 5, and its monohydrate, [(5).H2O]: A survey of the structures of related di- and tri-substituted hydroxy derivatives and their solvated compounds.
    Wardell SMSV, Wardell JL.
    Steroids; 2020 Jul; 159():108624. PubMed ID: 32156569
    [Abstract] [Full Text] [Related]

  • 4. Quantum mechanics models of the methanol dimer: OH⋯O hydrogen bonds of β-d-glucose moieties from crystallographic data.
    Cintrón MS, Johnson GP, French AD.
    Carbohydr Res; 2017 Apr 18; 443-444():87-94. PubMed ID: 28411418
    [Abstract] [Full Text] [Related]

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  • 6. Molecular structure of a D-homoandrostanyl steroid derivative: single crystal and powder diffraction analyses.
    Martinetto P, Terech P, Grand A, Ramasseul R, Dooryhée E, Anne M.
    J Phys Chem B; 2006 Aug 10; 110(31):15127-33. PubMed ID: 16884225
    [Abstract] [Full Text] [Related]

  • 7. Polymorphism in two biologically active dihydropyrimidinium hydrochloride derivatives: quantitative inputs towards the energetics associated with crystal packing.
    Panini P, Venugopala KN, Odhav B, Chopra D.
    Acta Crystallogr B Struct Sci Cryst Eng Mater; 2014 Aug 10; 70(Pt 4):681-96. PubMed ID: 25080247
    [Abstract] [Full Text] [Related]

  • 8. Conformational analysis of an acyclic tetrapeptide: ab-initio structure determination from X-ray powder diffraction, Hirshfeld surface analysis and electronic structure.
    Das U, Naskar J, Mukherjee AK.
    J Pept Sci; 2015 Dec 10; 21(12):845-52. PubMed ID: 26434376
    [Abstract] [Full Text] [Related]

  • 9. 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 20; 118(11):2089-106. PubMed ID: 24597713
    [Abstract] [Full Text] [Related]

  • 10. 2'-(4-Fluorophenyl)-[1,2,3]triazolo[4',5':16,17]androst-5-en-3beta-ol methanol hemisolvate.
    Thamotharan S, Parthasarathi V, Gupta R, Jindal DP, Linden A.
    Acta Crystallogr C; 2004 Jun 20; 60(Pt 6):o405-7. PubMed ID: 15178865
    [Abstract] [Full Text] [Related]

  • 11. Halogen and Hydrogen Bonding Interplay in the Crystal Packing of Halometallocenes.
    Shimizu K, Ferreira da Silva J.
    Molecules; 2018 Nov 13; 23(11):. PubMed ID: 30428578
    [Abstract] [Full Text] [Related]

  • 12. Ligand based pharmacophoric modelling and docking of bioactive pyrazolium 3-nitrophthalate (P3NP) on Bacillus subtilis, Aspergillus fumigatus and Aspergillus niger - Computational and Hirshfeld surface analysis.
    Balachandar S, Sethuram M, Muthuraja P, Shanmugavadivu T, Dhandapani M.
    J Photochem Photobiol B; 2016 Oct 13; 163():352-65. PubMed ID: 27614246
    [Abstract] [Full Text] [Related]

  • 13. Crystal structures of ecdysteroids: the role of solvent molecules in hydrogen bonding and isostructurality.
    Fábián L, Argay G, Kálmán A, Báthori M.
    Acta Crystallogr B; 2002 Aug 13; 58(Pt 4):710-20. PubMed ID: 12149562
    [Abstract] [Full Text] [Related]

  • 14. Influence of the position of the methyl substituent and N-oxide formation on the geometry and intermolecular interactions of 1-(phenoxyethyl)piperidin-4-ol derivatives.
    Żesławska E, Kalinowska-Tłuścik J, Nitek W, Marona H, Waszkielewicz AM.
    Acta Crystallogr C Struct Chem; 2020 Jan 01; 76(Pt 1):30-36. PubMed ID: 31919305
    [Abstract] [Full Text] [Related]

  • 15. Supramolecular sheets in (4H-chromeno[4,3-c]isoxazol-3-yl)methanol and its hydrated 8-methyl-substituted analogue at 100 K.
    Rajalakshmi P, Srinivasan N, Krishnakumar RV, Razak IA, Rosli MM.
    Acta Crystallogr C; 2012 Nov 01; 68(Pt 11):o481-4. PubMed ID: 23124468
    [Abstract] [Full Text] [Related]

  • 16. Structural reorganization of molecular sheets derived from cellulose II by molecular dynamics simulations.
    Miyamoto H, Umemura M, Aoyagi T, Yamane C, Ueda K, Takahashi K.
    Carbohydr Res; 2009 Jun 12; 344(9):1085-94. PubMed ID: 19375694
    [Abstract] [Full Text] [Related]

  • 17. 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 15; 145():563-574. PubMed ID: 25804368
    [Abstract] [Full Text] [Related]

  • 18. The methanol disolvate and the dihydrate of fexofenadine, an antihistamine drug.
    Tessler L, Goldberg I.
    Acta Crystallogr C; 2005 Dec 15; 61(Pt 12):o707-10. PubMed ID: 16330854
    [Abstract] [Full Text] [Related]

  • 19. 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 05; 27(1):13. PubMed ID: 33403477
    [Abstract] [Full Text] [Related]

  • 20. Solid-state behavior of cromolyn sodium hydrates.
    Chen LR, Young VG, Lechuga-Ballesteros D, Grant DJ.
    J Pharm Sci; 1999 Nov 05; 88(11):1191-200. PubMed ID: 10564069
    [Abstract] [Full Text] [Related]

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