Materials Data on Sn3(HO2)2 by Materials Project

Abstract

Sn3(HO2)2 is Indium structured and crystallizes in the monoclinic Cc space group. The structure is zero-dimensional and consists of four Sn3(HO2)2 clusters. there are six inequivalent Sn2+ sites. In the first Sn2+ site, Sn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.14–2.47 Å. In the second Sn2+ site, Sn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.14–2.49 Å. In the third Sn2+ site, Sn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.13–2.44 Å. In the fourth Sn2+ site, Sn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.14–2.43 Å. In the fifth Sn2+ site, Sn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.15–2.41 Å. In the sixth Sn2+ site, Sn2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Sn–O bond distances ranging from 2.15–2.39 Å. There are four inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the third H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. There are eight inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three Sn2+ and one H1+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to three Sn2+ and one H1+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to three Sn2+ and one H1+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to three Sn2+ and one H1+ atom. In the fifth O2- site, O2- is bonded in a trigonal non-coplanar geometry to three Sn2+ atoms. In the sixth O2- site, O2- is bonded in a trigonal non-coplanar geometry to three Sn2+ atoms. In the seventh O2- site, O2- is bonded in a trigonal non-coplanar geometry to three Sn2+ atoms. In the eighth O2- site, O2- is bonded in a trigonal non-coplanar geometry to three Sn2+ atoms.