All Stories

  1. Molecular and crystal structure, Hirshfeld analysis and DFT investigation of 5-(furan-2-ylmethylidene)thiazolo[3,4-a]benzimidazole-2-thione
  2. Crystal and molecular structure of (2Z,5Z)-3-(2-methoxyphenyl)-2-[(2-methoxyphenyl)imino]-5-(4-nitrobenzylidene)thiazolidin-4-one
  3. Crystal structure and Hirshfeld surface analysis of ethyl 2-{[4-ethyl-5-(quinolin-8-yloxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
  4. Crystal structure of thiazolidinones derivative
  5. Molecular structure investigation of Z-3N(2-ethoxyphenyl)-2-N′(2-ethoxyphenyl)-imino-thiazolidin-4-one by ab initio, DFT and X-ray diffraction methods
  6. Determination of electrostatic parameters of a coumarin derivative compound C17H13NO3by x-ray and density functional theory
  7. Theoretical and Experimental Electrostatic Potential around the m-Nitrophenol Molecule
  8. Structural Evolution according to the temperature of the Compound LiNbO3
  9. Structural and electron charge density studies of a nonlinear optical compound 4,4 di-methyl amino cyano biphenyl
  10. Electron Charge Density Distribution from X-Ray Diffraction Study of the 4-Methoxybenzenecarbothioamide Compound
  11. Synthesis and Structural Study of Triphenylbismuth Bis (Salicylate)
  12. Synthesis and Structural Determination of Novel 5-Arylidene-3-N(2-alkyloxyaryl)-2-thioxothiazolidin-4-ones
  13. Charge density study of an nonlinear optical compound – a combined experimental and theoretical study
  14. Topological analysis and charge-density studies ofm-nitrophenol compound. A combined experimental and theoretical study
  15. Synthesis and Molecular Structure Investigation by DFT and X-Ray Diffraction of ARNO
  16. Theoretical and crystallographic calculations onmeta-nitrophenol: a nonlinear optical compound
  17. Electron charge-density distribution in an organic compound: 4,4-dimethylcyanobiphenyl (DMACB)
  18. The molecular dipole moment of a nonlinear optical compound 4,4-dimethylcyanobiphenyl (DMACB): theoretical and X-ray diffraction study
  19. Electron charge-density distribution in an organic compound: the 4,4-dimethyl cyano biphenyl (DMACB)
  20. The molecular dipole moment of a nonlinear optical compound (m-nitrophenol)
  21. Electron Charge Density Distribution from X-ray Diffraction Study of the M-Nitrophenol Compound in the Monoclinic Form
  22. A Comparative X-ray Diffraction Study and Ab Initio Calculation on RU60358, a New Pyrethroid
  23. Evolution structurale en fonction de la température du composé LiNbO 3
  24. Capability of X-ray diffraction to the determination of the macroscopic linear susceptibility in a crystalline environment: the case of 3-Methyl 4-Nitropyridine N-oxide (POM)