Materials Data on SnH2C4O3 by Materials Project
SnC4H2O3 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of two SnC4H2O3 ribbons oriented in the (0, 1, 0) direction. Sn4+ is bonded in a trigonal bipyramidal geometry to three C and two O2- atoms. There are a spread of Sn–C bond distances ranging from 2.20–2.22 Å. There are one shorter (2.25 Å) and one longer (2.31 Å) Sn–O bond lengths. There are four inequivalent C sites. In the first C site, C is bonded in a distorted bent 120 degrees geometry to two O2- atoms. There is one shorter (1.25 Å) and one longer (1.28 Å) C–O bond length. In the second C site, C is bonded in a single-bond geometry to one Sn4+ atom. In the third C site, C is bonded in a single-bond geometry to one Sn4+ atom. In the fourth C site, C is bonded in a single-bond geometry to one Sn4+ atom. There are two 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 0.98 Å. In the second H1+ site, H1+ is bonded in a distorted single-bond geometry to two O2- atoms. There is one shorter (1.00 Å) and one longer (1.67 Å) H–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one C and one H1+ atom. In the second O2- site, O2- is bonded in a distorted water-like geometry to one Sn4+ and two H1+ atoms. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Sn4+ and one C atom.
- Research Organization:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Contributing Organization:
- MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- OSTI ID:
- 1281922
- Report Number(s):
- mp-698310
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on Sn4H26(Br4O5)3 by Materials Project
Materials Data on Ca2Al2Si6Sn(H3O11)2 by Materials Project