The assembly coated the scientific lifetime of Professor Sir Geoffrey Wilkinson from the angle of collaborators, family and friends and celebrated three anniversaries, the centenary of his delivery (2021), the half-century anniversary of the Nobel prize (2023) and 70 years virtually to the day (1 April) for the reason that publication of the seminal article on Ferrocene (2022).
The assembly was organised as “inverse hybrid” (to make use of the brand new terminology), with a most capability in-person viewers attending together with fourteen audio system, three of whom had been distant and one who couldn’t attend on the day however whose presentation was given on their behalf. I can’t give abstracts for the talks right here, however be aware two widespread themes that I assumed emerged throughout the day.
- All of the audio system discovered themes in both their recollections of Wilkinson and their time in his laboratories or their present analysis work that present how he continues to affect, together with the well-known textual content e-book that he co-wrote, the fashionable world of chemistry. He actually left a outstanding legacy.
- It is a private statement, however in his day, Wilkinson was famously sceptical of the flexibility of molecular modelling to forged profound insights into the molecules his group had been learning. Yesterday I believe with just one or two exceptions, the talks had been accompanied by “DFT modelling” serving to to offer such insights, both into the response mechanisms through power profiles or into the properties of the molecules themselves, together with their spectroscopy.
A small exhibition of artefacts included his well-known portrait, all of the editions of the textual content e-book and different gadgets from his desk.
Lastly, I assumed I’d discover the well-known controversy surrounding the mannequin of ferrocene which is proven within the pictures under. It’s proven with the 2 cyclopentadienyl rings in a so-called “eclipsed” conformation. To forged mild on this, I present a search of the Cambridge crystal database of all molecules with this sub-structure. There are 24,868 of them.
The histogram plot of the dihedral angle is proven under. The staggered geometry has a dihedral of 36° and you’ll see a small most at this level within the distribution under. However that is dwarfed by 0°, the worth for the eclipsed orientation. The barrier to rotation is identified to be very small, and that is mirrored within the virtually steady distribution amongst these 24,868 molecules.