Materials Data on AgH2SNO3 by Materials Project

Abstract

AgNH2SO3 crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. Ag1+ is bonded in a 5-coordinate geometry to one N5+ and four O2- atoms. The Ag–N bond length is 2.33 Å. There are a spread of Ag–O bond distances ranging from 2.47–2.65 Å. N5+ is bonded in a distorted water-like geometry to one Ag1+, two H1+, and one S2- atom. There is one shorter (1.03 Å) and one longer (1.04 Å) N–H bond length. The N–S bond length is 1.70 Å. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N5+ atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N5+ atom. S2- is bonded in a tetrahedral geometry to one N5+ and three O2- atoms. There are a spread of S–O bond distances ranging from 1.46–1.49 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Ag1+ and one S2- atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one Ag1+ and one S2- atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to one Ag1+ and one S2- atom.