The Relevance of Experimental Charge Density Analysis in Unraveling Noncovalent Interactions in Molecular Crystals

The Relevance of Experimental Charge Density Analysis in Unraveling Noncovalent Interactions in Molecular Crystals

The work carried out by our research group over the last couple of decades in the context of quantitative crystal engineering involves the analysis of intermolecular interactions such as carbon (tetrel) bonding, pnicogen bonding, chalcogen bonding, and halogen bonding using experimental charge densi...

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Bibliographic Details
Main Authors: Sajesh P. Thomas, Amol G. Dikundwar, Sounak Sarkar, Mysore S. Pavan, Rumpa Pal, Venkatesha R. Hathwar, Tayur N. Guru Row
Format: Article
Language:English
Published: MDPI AG 2022-06-01
Series:Molecules
Subjects:
non-covalent interactions
electron density
qtaim
multipole modelling
crystal
Online Access:https://www.mdpi.com/1420-3049/27/12/3690

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https://www.mdpi.com/1420-3049/27/12/3690

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