Materials Data on SnCNCl3 by Materials Project
SnCl2CNCl crystallizes in the monoclinic Pc space group. The structure is two-dimensional and consists of two cyanogen chloride molecules and one SnCl2 sheet oriented in the (0, 1, 0) direction. In the SnCl2 sheet, Sn2+ is bonded to four Cl1- atoms to form distorted corner-sharing SnCl4 tetrahedra. There are a spread of Sn–Cl bond distances ranging from 2.59–2.98 Å. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a bent 150 degrees geometry to two equivalent Sn2+ atoms. In the second Cl1- site, Cl1- is bonded in a linear geometry to two equivalent Sn2+ atoms.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1730858
- Report Number(s):
- mp-1103126
- Country of Publication:
- United States
- Language:
- English
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