Materials Data on CdCoH18N6Cl5 by Materials Project

doi:10.17188/1200094

Title: Materials Data on CdCoH18N6Cl5 by Materials Project

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Abstract

Co(NH3)6CdCl5 is Halite, Rock Salt structured and crystallizes in the cubic Fd-3c space group. The structure is zero-dimensional and consists of thirty-two azane;cobalt molecules and thirty-two CdCl5 clusters. In each CdCl5 cluster, Cd2+ is bonded in a trigonal bipyramidal geometry to five Cl1- atoms. There are two shorter (2.54 Å) and three longer (2.65 Å) Cd–Cl bond lengths. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Cd2+ atom. In the second Cl1- site, Cl1- is bonded in a single-bond geometry to one Cd2+ atom.

Publication Date:: 2014-02-19

Other Number(s):: mp-24430

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Cd-Cl-Co-H-N; CdCoH18N6Cl5; crystal structure

OSTI Identifier:: 1200094

DOI:: https://doi.org/10.17188/1200094

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                    Materials Data on CdCoH18N6Cl5 by Materials Project.  United States: N. p., 2014. 
        Web.  doi:10.17188/1200094.

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                    Materials Data on CdCoH18N6Cl5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1200094

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                    2014.  
"Materials Data on CdCoH18N6Cl5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1200094.  https://www.osti.gov/servlets/purl/1200094. Pub date:Wed Feb 19 04:00:00 UTC 2014

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@article{osti_1200094,

  title        = {Materials Data on CdCoH18N6Cl5 by Materials Project},

  
  abstractNote = {Co(NH3)6CdCl5 is Halite, Rock Salt structured and crystallizes in the cubic Fd-3c space group. The structure is zero-dimensional and consists of thirty-two azane;cobalt molecules and thirty-two CdCl5 clusters. In each CdCl5 cluster, Cd2+ is bonded in a trigonal bipyramidal geometry to five Cl1- atoms. There are two shorter (2.54 Å) and three longer (2.65 Å) Cd–Cl bond lengths. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Cd2+ atom. In the second Cl1- site, Cl1- is bonded in a single-bond geometry to one Cd2+ atom.},

  doi          = {10.17188/1200094},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2014},

  month        = {2}

}

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DOI: https://doi.org/10.17188/1200094

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