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DOE OSTI · 1281128

Materials Data on AuC5(SCl)4 by Materials Project

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Abstract

AuCl4C5S4 crystallizes in the monoclinic C2/m space group. The structure is zero-dimensional and consists of four 4,5-bis(methylsulfanyl)-1,3-dithiole molecules and four AuCl4 clusters. In each AuCl4 cluster, Au1- is bonded in a rectangular see-saw-like geometry to four Cl1- atoms. There are a spread of Au–Cl bond distances ranging from 2.31–2.34 Å. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Au1- atom. In the second Cl1- site, Cl1- is bonded in a single-bond geometry to one Au1- atom. In the third Cl1- site, Cl1- is bonded in a single-bond geometry to one Au1- atom.

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36 MATERIALS SCIENCEAu-C-Cl-SAuC5(SCl)4crystal structure

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2020-07-22. Materials Data on AuC5(SCl)4 by Materials Project. https://doi.org/10.17188/1281128

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DOE OSTI2026

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