Startseite The crystal structure of trechmannite, AgAsS2*
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The crystal structure of trechmannite, AgAsS2*

Veröffentlicht/Copyright: 28. Juli 2010
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Abstract

The crystal structure of trechmannite, AgAsS2, has been determined with the use of three-dimensional intensity data. The crystal is rhombohedral, having the unit-cell dimensions arh = 8.62 Å, αrh = 108°17′, ahex = 13.98 Å, chex = 9.12 Å, space group C3i2R[unk]. There are 6 (rh.) or 18 (hex.) formula units in the cell. The structure was solved by interpretation of a three-dimensional partial Patterson function synthesized only with superlattice reflections and by the heavy-atom method.

The crystal has a defect, distorted, galena-type structure, the metal atom positions and the S-atom positions on the threefold rotation axes being vacant. Six S atoms and six As atoms surround the vacant sites for metal and for S respectively.

As has three nearest S neighbours at distances between 2,218 Å and 2.307 Å, which form the usual trigonal AsS3 pyramid. Three of these AsS3 pyramids form a threefold AS3S6 ring by sharing S atoms. This result could be expected for stereochemical reasons. If the ratio As:S is 1:2, the only possibilities are infinite chains of linked AsS3 pyramids or rings, with a threefold axis a threefold As3S6 ring is probable.

Ag has three nearest S neighbours between 2.599 Å and 2.646 Å, with which it forms a very flat pyramid. A fourth S atom is at an intermediate distance of 2.735 Å. Together these four S atoms form a distorted tetrahedral coordination around the Ag atoms.

Published Online: 2010-07-28
Published in Print: 1969-05
Heruntergeladen am 17.9.2025 von https://www.degruyterbrill.com/document/doi/10.1524/zkri.1969.129.1-4.163/html
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