Materials Data on Os2Pt(CO)9 by Materials Project

doi:10.17188/1280993

Title: Materials Data on Os2Pt(CO)9 by Materials Project

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Abstract

(Os(CO)4)2PtCO crystallizes in the orthorhombic Pna2_1 space group. The structure is zero-dimensional and consists of sixteen Os(CO)4 clusters and eight PtCO clusters. In four of the Os(CO)4 clusters, Os2- is bonded in a distorted rectangular see-saw-like geometry to four C+2.22+ atoms. There are a spread of Os–C bond distances ranging from 1.91–1.97 Å. There are four inequivalent C+2.22+ sites. In the first C+2.22+ site, C+2.22+ is bonded in a distorted linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the second C+2.22+ site, C+2.22+ is bonded in a linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the third C+2.22+ site, C+2.22+ is bonded in a distorted linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the fourth C+2.22+ site, C+2.22+ is bonded in a linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In the second O2- site, O2- is bonded in a single-bond geometry tomore »« less

Authors:: The Materials Project

Publication Date:: 2014-03-22

Other Number(s):: mp-650695

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; Os2Pt(CO)9; C-O-Os-Pt

OSTI Identifier:: 1280993

DOI:: https://doi.org/10.17188/1280993

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                    The Materials Project. Materials Data on Os2Pt(CO)9 by Materials Project.  United States: N. p., 2014. 
        Web.  doi:10.17188/1280993.

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                    The Materials Project. Materials Data on Os2Pt(CO)9 by Materials Project.  United States.  doi:https://doi.org/10.17188/1280993

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                    The Materials Project. 2014.  
"Materials Data on Os2Pt(CO)9 by Materials Project".  United States.  doi:https://doi.org/10.17188/1280993.  https://www.osti.gov/servlets/purl/1280993. Pub date:Sat Mar 22 00:00:00 EDT 2014

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@article{osti_1280993,

  title        = {Materials Data on Os2Pt(CO)9 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {(Os(CO)4)2PtCO crystallizes in the orthorhombic Pna2_1 space group. The structure is zero-dimensional and consists of sixteen Os(CO)4 clusters and eight PtCO clusters. In four of the Os(CO)4 clusters, Os2- is bonded in a distorted rectangular see-saw-like geometry to four C+2.22+ atoms. There are a spread of Os–C bond distances ranging from 1.91–1.97 Å. There are four inequivalent C+2.22+ sites. In the first C+2.22+ site, C+2.22+ is bonded in a distorted linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the second C+2.22+ site, C+2.22+ is bonded in a linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the third C+2.22+ site, C+2.22+ is bonded in a distorted linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the fourth C+2.22+ site, C+2.22+ is bonded in a linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In the third O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In twelve of the Os(CO)4 clusters, Os2- is bonded in a rectangular see-saw-like geometry to four C+2.22+ atoms. There are a spread of Os–C bond distances ranging from 1.92–1.97 Å. There are four inequivalent C+2.22+ sites. In the first C+2.22+ site, C+2.22+ is bonded in a distorted linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the second C+2.22+ site, C+2.22+ is bonded in a linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the third C+2.22+ site, C+2.22+ is bonded in a distorted linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. In the fourth C+2.22+ site, C+2.22+ is bonded in a linear geometry to one Os2- and one O2- atom. The C–O bond length is 1.16 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In the third O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to one C+2.22+ atom. In each PtCO cluster, Pt2+ is bonded in a distorted single-bond geometry to one C+2.22+ atom. The Pt–C bond length is 1.85 Å. C+2.22+ is bonded in a distorted linear geometry to one Pt2+ and one O2- atom. The C–O bond length is 1.16 Å. O2- is bonded in a single-bond geometry to one C+2.22+ atom.},

  doi          = {10.17188/1280993},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2014},

  month        = {3}

}

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DOI: https://doi.org/10.17188/1280993

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