Insight from electron density and energy framework analysis on the structural features of Fx-TCNQ (x = 0, 2, 4) family of molecules

Shukla, R.; Ruzié, C.; Schweicher, G.; Kennedy, A.R.; Geerts, Y.H.; Chopra, D.; Chattopadhyay, B.

doi:10.1107/S2052520618017109

Acta Crystallographica Section B
Acta Crystallographica
Section B STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS

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Figure 2
(a–d) Molecular plots depicting the presence of F⋯C (π) (3,−1) bond critical point. (e–h) 2D deformation density plots showing the presence of charge-concentrated (blue) and charge-depleted (red) regions between the interacting atoms.

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 75| Part 1| February 2019| Pages 71-78

https://doi.org/10.1107/S2052520618017109

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