Primary study2023
Electrically conductive [Fe4S4]-based organometallic polymers
Kadota K., Chen T., Gormley E.L. et al. · Chemical Science · 2023
Reported here: BDT/thiolate-ligated [Fe4S4] computational/model cluster
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BDT/thiolate-ligated [Fe4S4] computational/model cluster
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2023–2023publication span
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| Paper and reported name | Formula and components | Structure context | Source |
|---|---|---|---|
| BDT/thiolate-ligated [Fe4S4] computational/model cluster2023 · Electrically conductive [Fe4S4]-based organometallic polymers | [Fe4S4] cluster with BDT ligands; overall charge -2 e in DFTModel cuboidal [Fe4S4] cluster. · BDT / benzenedithiolate or thiolate ligands. | 0D · Model SystemDFT-relaxed comparison model for thiol-based [Fe4S4] CP/MOF bonding. | S4 · Computational Details · Fig. 3d |