Materials Data on Sn2(PCl8)3 by Materials Project

doi:10.17188/1675997

Title: Materials Data on Sn2(PCl8)3 by Materials Project

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Abstract

(SnCl6)2(PCl4)3 crystallizes in the tetragonal P4_2/mbc space group. The structure is zero-dimensional and consists of twelve [pcl4]+1 molecules and eight SnCl6 clusters. In each SnCl6 cluster, Sn is bonded in an octahedral geometry to six Cl atoms. There are a spread of Sn–Cl bond distances ranging from 2.46–2.49 Å. There are five inequivalent Cl sites. In the first Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the second Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the third Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the fourth Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the fifth Cl site, Cl is bonded in a single-bond geometry to one Sn atom.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1209397

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; Sn2(PCl8)3; Cl-P-Sn

OSTI Identifier:: 1675997

DOI:: https://doi.org/10.17188/1675997

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                    The Materials Project. Materials Data on Sn2(PCl8)3 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1675997.

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                    The Materials Project. Materials Data on Sn2(PCl8)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1675997

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                    The Materials Project. 2019.  
"Materials Data on Sn2(PCl8)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1675997.  https://www.osti.gov/servlets/purl/1675997. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1675997,

  title        = {Materials Data on Sn2(PCl8)3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {(SnCl6)2(PCl4)3 crystallizes in the tetragonal P4_2/mbc space group. The structure is zero-dimensional and consists of twelve [pcl4]+1 molecules and eight SnCl6 clusters. In each SnCl6 cluster, Sn is bonded in an octahedral geometry to six Cl atoms. There are a spread of Sn–Cl bond distances ranging from 2.46–2.49 Å. There are five inequivalent Cl sites. In the first Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the second Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the third Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the fourth Cl site, Cl is bonded in a single-bond geometry to one Sn atom. In the fifth Cl site, Cl is bonded in a single-bond geometry to one Sn atom.},

  doi          = {10.17188/1675997},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1675997

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