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Electrochemical Properties and Structure of Multi-Ferrocenyl Phosphorus Thioesters.

ABSTRACT: The reaction of triferrocenylthiophosphite with elemental sulfur leads to triferrocenyltetrathiophosphate. The molecule of tetrathiophosphate adopts propeller-like all synclinal-conformation of the ferrocenyl fragments respective to the P=S bond. All ferrocenyl groups have nearly ideal eclipsed conformation of the cyclopentadienyl fragments. The Fc3S3P (1), Fc3S3P=O, (2) and Fc3S3P=S (3) demonstrate three reversible and well-separated ferrocenyl-based redox events. The electronic structures of 1-3 have been studied quantum-chemically; the energies and composition of frontier orbitals have been calculated.

SUBMITTER: Shekurov R

PROVIDER: S-EPMC7070987 | biostudies-literature | 2020 Feb

REPOSITORIES: biostudies-literature

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Electrochemical Properties and Structure of Multi-Ferrocenyl Phosphorus Thioesters.

Shekurov Ruslan R Khrizanforov Mikhail M Gerasimova Tatiana T Yamaleeva Zilya Z Ivshin Kamil K Lakomkina Alyona A Bezkishko Ilya I Kononov Aleksandr A Sinyashin Oleg O Budnikova Yulia Y Kataeva Olga O Miluykov Vasily V

Molecules (Basel, Switzerland) 20200219 4

The reaction of triferrocenylthiophosphite with elemental sulfur leads to triferrocenyltetrathiophosphate. The molecule of tetrathiophosphate adopts propeller-like all synclinal-conformation of the ferrocenyl fragments respective to the P=S bond. All ferrocenyl groups have nearly ideal eclipsed conformation of the cyclopentadienyl fragments. The Fc3S3P (1), Fc3S3P=O, (2) and Fc3S3P=S (3) demonstrate thr ...[more]

PMID: 32093122

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Dataset Information

Electrochemical Properties and Structure of Multi-Ferrocenyl Phosphorus Thioesters.

Publications

Electrochemical Properties and Structure of Multi-Ferrocenyl Phosphorus Thioesters.

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