Materials Data on ReH2NCl4O by Materials Project
ReNH2OCl4 is beta Sn-like structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four ReNH2OCl4 clusters. Re7+ is bonded in a distorted octahedral geometry to one N3-, one O2-, and four Cl1- atoms. The Re–N bond length is 1.68 Å. The Re–O bond length is 2.48 Å. There are two shorter (2.31 Å) and two longer (2.33 Å) Re–Cl bond lengths. N3- is bonded in a single-bond geometry to one Re7+ atom. H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. O2- is bonded in a water-like geometry to one Re7+ and two equivalent H1+ atoms. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Re7+ atom. In the second Cl1- site, Cl1- is bonded in a single-bond geometry to one Re7+ 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:
- 1726884
- Report Number(s):
- mp-1203672
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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