Materials Data on AgHO2 by Materials Project

AgHO2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are two inequivalent Ag3+ sites. In the first Ag3+ site, Ag3+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.11–2.50 Å. In the second Ag3+ site, Ag3+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.11–2.50 Å. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.61 Å) H–O bond length. In the second H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.62 Å) H–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two Ag3+ and two H1+ atoms. In the second O2- site, O2- is bonded in a trigonal planar geometry to two Ag3+ and one O2- atom. The O–O bond length is 1.30 Å. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two Ag3+ and two H1+ atoms. In the fourth O2- site, O2- is bonded in a trigonal planar geometry to two Ag3+ and one O2- atom.

AgHO₂以三斜晶系P1空间群结晶，其结构为三维骨架结构。体系中存在两个不等价的银(III)阳离子（Ag³+）位点：在第一个银(III)阳离子位点，Ag³+与四个氧阴离子（O²-）形成矩形跷跷板状配位几何，Ag–O键长分布范围为2.11~2.50 Å（埃）；在第二个银(III)阳离子位点，Ag³+同样与四个氧阴离子（O²-）形成矩形跷跷板状配位几何，Ag–O键长分布范围同样为2.11~2.50 Å。体系中存在两个不等价的氢离子（H⁺）位点：在第一个氢离子位点，H⁺与两个氧阴离子（O²-）形成畸变直线型配位几何，其H–O键长分别为1.02 Å（较短）与1.61 Å（较长）；在第二个氢离子位点，H⁺与两个氧阴离子（O²-）形成畸变直线型配位几何，其H–O键长分别为1.02 Å（较短）与1.62 Å（较长）。体系中存在四个不等价的氧阴离子（O²-）位点：在首个氧阴离子位点，该O²-以畸变单键配位几何与两个银(III)阳离子及两个氢离子成键；在第二个氧阴离子位点，该O²-以三角平面配位几何与两个银(III)阳离子及一个氧阴离子成键，O–O键长为1.30 Å；在第三个氧阴离子位点，该O²-以畸变单键配位几何与两个银(III)阳离子及两个氢离子成键；在第四个氧阴离子位点，该O²-以三角平面配位几何与两个银(III)阳离子及一个氧阴离子成键。