Materials Data on H12RhC8NO6 by Materials Project

doi:10.17188/1183916

Title: Materials Data on H12RhC8NO6 by Materials Project

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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 »« less

Authors:: The Materials Project

Publication Date:: Sat May 30 00:00:00 EDT 2020

Other Number(s):: mp-555813

DOE Contract Number:: AC02-05CH11231; EDCBEE

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)

Collaborations:: MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE

Keywords:: crystal structure; H12RhC8NO6; C-H-N-O-Rh

OSTI Identifier:: 1183916

DOI:: https://doi.org/10.17188/1183916

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                    The Materials Project. Materials Data on H12RhC8NO6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1183916.

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                    The Materials Project. Materials Data on H12RhC8NO6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1183916

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                    The Materials Project. 2020.  
"Materials Data on H12RhC8NO6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1183916.  https://www.osti.gov/servlets/purl/1183916. Pub date:Sat May 30 00:00:00 EDT 2020

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@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         = {Sat May 30 00:00:00 EDT 2020},

  month        = {Sat May 30 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1183916

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