Materials Data on RuN5Cl3 by Materials Project
RuN4ClNCl2 crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of four dichloramine molecules and four RuN4Cl ribbons oriented in the (1, 0, 0) direction. In each RuN4Cl ribbon, Ru4+ is bonded in a tetrahedral geometry to four N+0.20- atoms. There are a spread of Ru–N bond distances ranging from 1.69–1.97 Å. There are three inequivalent N+0.20- sites. In the first N+0.20- site, N+0.20- is bonded in a single-bond geometry to one Ru4+ atom. In the second N+0.20- site, N+0.20- is bonded in a single-bond geometry to one Ru4+ atom. In the third N+0.20- site, N+0.20- is bonded in a distorted bent 120 degrees geometry to one Ru4+ and one Cl1- atom. The N–Cl bond length is 1.58 Å. Cl1- is bonded in a bent 120 degrees geometry to two equivalent N+0.20- 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:
- 1759863
- Report Number(s):
- mp-1179667
- Country of Publication:
- United States
- Language:
- English
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