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Title: Materials Data on H12RhC8NO6 by Materials Project

Abstract

Rh(C2O3)2N(CH3)4 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four tetramethylammonium molecules and four Rh(C2O3)2 clusters. In each Rh(C2O3)2 cluster, Rh3+ is bonded in a rectangular see-saw-like geometry to two C and two O2- atoms. Both Rh–C bond lengths are 1.85 Å. Both Rh–O bond lengths are 2.08 Å. 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 (1.24 Å) and one longer (1.31 Å) C–O bond length. In the second C site, C is bonded in a distorted bent 120 degrees geometry to two O2- atoms. There is one shorter (1.24 Å) and one longer (1.30 Å) C–O bond length. In the third C site, C is bonded in a linear geometry to one Rh3+ and one O2- atom. The C–O bond length is 1.16 Å. In the fourth C site, C is bonded in a distorted linear geometry to one Rh3+ and one O2- atom. The C–O bond length is 1.16 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degreesmore » geometry to one Rh3+ and one C atom. In the second O2- site, O2- is bonded in a single-bond geometry to one C atom. In the third O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Rh3+ and one C atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to one C atom. In the fifth O2- site, O2- is bonded in a single-bond geometry to one C atom. In the sixth O2- site, O2- is bonded in a single-bond geometry to one C atom.« less

Publication Date:
Other Number(s):
mp-555813
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; H12RhC8NO6; C-H-N-O-Rh
OSTI Identifier:
1183916
DOI:
10.17188/1183916

Citation Formats

The Materials Project. Materials Data on H12RhC8NO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1183916.
The Materials Project. Materials Data on H12RhC8NO6 by Materials Project. United States. doi:10.17188/1183916.
The Materials Project. 2020. "Materials Data on H12RhC8NO6 by Materials Project". United States. doi:10.17188/1183916. https://www.osti.gov/servlets/purl/1183916. Pub date:Sat May 30 00:00:00 EDT 2020
@article{osti_1183916,
title = {Materials Data on H12RhC8NO6 by Materials Project},
author = {The Materials Project},
abstractNote = {Rh(C2O3)2N(CH3)4 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four tetramethylammonium molecules and four Rh(C2O3)2 clusters. In each Rh(C2O3)2 cluster, Rh3+ is bonded in a rectangular see-saw-like geometry to two C and two O2- atoms. Both Rh–C bond lengths are 1.85 Å. Both Rh–O bond lengths are 2.08 Å. 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 (1.24 Å) and one longer (1.31 Å) C–O bond length. In the second C site, C is bonded in a distorted bent 120 degrees geometry to two O2- atoms. There is one shorter (1.24 Å) and one longer (1.30 Å) C–O bond length. In the third C site, C is bonded in a linear geometry to one Rh3+ and one O2- atom. The C–O bond length is 1.16 Å. In the fourth C site, C is bonded in a distorted linear geometry to one Rh3+ and one O2- atom. The C–O bond length is 1.16 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Rh3+ and one C atom. In the second O2- site, O2- is bonded in a single-bond geometry to one C atom. In the third O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Rh3+ and one C atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to one C atom. In the fifth O2- site, O2- is bonded in a single-bond geometry to one C atom. In the sixth O2- site, O2- is bonded in a single-bond geometry to one C atom.},
doi = {10.17188/1183916},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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