Research Article
Open Access
Intermolecular Interactions and Fingerprint Plots with Hirshfeld Surface Analysis
1Sinop University
2Ondokuz Mayıs University
✉ Corresponding author: Zeynep Demircioğlu · zdemricioglu@sinop.edu.tr
Proceedings 2nd International Symposium on Innovative Approaches in Scientific Studies
Volume 3 Pages 698–700 Year 2018
References
- S.K. Wolff, D.J. Grimwood, J.J. McKinnon, M.J. Turner, D. Jayatilaka , M.A. Spackman, Crystal Explorer (Version 3.0), University of Western Australia, 2012 .
- S.K. Seth, ‘’ Tuning the formation of MOFs by pH influence: X-ray structural variations and Hirshfeld surface analyses of with cadmium chlorid,‘’ Cryst. Eng. Comm., vol. 15, pp. 1772, 2013.
- S.K. Seth,’’ Structural elucidation and contribution of intermolecular interactions in O-hydroxy acyl aromatics: Insights from X-ray and Hirshfeld surface analysis,‘’ J. Mol. Struct., vol. 70, pp. 1064, 2014.
- S.K. Wolff, D.J. Grimwood, J.J. McKinnon, D. Jayatilaka, M.A. Spackman, Crystal Explorer 3.1, University of Western Australia, Perth, Australia, 2012.
- F.L. Hirshfeld, ‘’ Bonded-atom fragments for describing molecular charge densities,’’ Theor. Chim.Acta, vol. 44, pp. 129, 1977.
- S.M. Soliman, J. Albering, and M.A.M. Abu-Youssef, ‘’ Structural Analyses of Two New Highly Distorted Octahedral Copper(II) Complexes with Quinoline: Type Ligands; Hirshfeld, AIM and NBO studies,’’ Polyhedron, vol. 127, pp. 36-50,2017.
- M.A. Spackman, P.G. Byrom, ‘’ A novel definition of a molecule in a crystal, ‘’Chem. Phys. Lett.,vol. 267, pp. 215, 1997.
- A. Parkin, G. Barr, W. Dong, C.J. Gilmore, D. Jayatilaka, J.J. Mckinnon, M.A. Spackman, and C.C. Wilson, ‘’ Comparing entire crystal structures: structural genetic fingerprinting,‘’Cryst. Eng. Comm., vol. 9 pp. 648, 2007.