view article
Figure 6
Non-covalent inter­action (NCI) isosurface plot (isovalue = 0.4) of dimers based on the reduced density gradient (RDG) computed from the electron density at the B3LYP-D4/def2-TZVPP level (Schrödinger, 2025BB26). The orange spheres highlight the bond critical points (BCP) of the identified non-covalent inter­actions.

Journal logoCRYSTALLOGRAPHIC
COMMUNICATIONS
ISSN: 2056-9890
Volume 81| Part 6| June 2025|
https://doi.org/10.1107/S2056989025004074
Follow Acta Cryst. E
Sign up for e-alerts
E-alerts
Follow Acta Cryst. on Twitter
Twitter
Follow us on facebook
Facebook
Sign up for RSS feeds
RSS