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14–17 Mar 2022
Europe/Berlin timezone

Charge-Density Analysis of a disordered Aluminium Dihydrite Complex

VC Room link
/redirectVC/3086
16 Mar 2022, 16:45
2h
Poster Structural Chemistry & New crystal structures Postersession

Speaker

Christian Köhler (Georg-August-Universität Göttingen)

Description

In this work, we strive to investigate in how far a successful Hansen & Coppens multipole refinement with subsequent Bader QTAIM analysis of the only slightly disordered compound AlH2MeBOX can be achieved. Bis(benzoxazol‐2‐yl)methandid (BOX) ligands are a family of readily available ligands with easily customizable steric demand. Therefore, BOX ligands are a promising alternative to the ubiquitous NacNac ligands.

Primary authors

Christian Köhler (Georg-August-Universität Göttingen) Prof. Dietmar Stalke (Georg-August-Universität Göttingen) Dr Regine Herbst-Irmer (Georg-August-Universität Göttingen)

Presentation materials