Materials Data on FeSb(ClO)8 by Materials Project

doi:10.17188/1695899

Title: Materials Data on FeSb(ClO)8 by Materials Project

Dataset
Other Related Research

Abstract

FeCl2(O)4SbCl6(O2)2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one dichloroiron;tetrahydrate molecule, four water molecules, and one SbCl6 cluster. In the SbCl6 cluster, Sb is bonded in an octahedral geometry to six Cl atoms. There are two shorter (2.36 Å) and four longer (2.44 Å) Sb–Cl bond lengths. There are two inequivalent Cl sites. In the first Cl site, Cl is bonded in a single-bond geometry to one Sb atom. In the second Cl site, Cl is bonded in a single-bond geometry to one Sb atom.

Publication Date:: 2020-05-03

Other Number(s):: mp-1189473

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; Cl-Fe-O-Sb; FeSb(ClO)8; crystal structure

OSTI Identifier:: 1695899

DOI:: https://doi.org/10.17188/1695899

Citation Formats


                    Materials Data on FeSb(ClO)8 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1695899.

Copy to clipboard


                    Materials Data on FeSb(ClO)8 by Materials Project.  United States.  doi:https://doi.org/10.17188/1695899

Copy to clipboard


                    2020.  
"Materials Data on FeSb(ClO)8 by Materials Project".  United States.  doi:https://doi.org/10.17188/1695899.  https://www.osti.gov/servlets/purl/1695899. Pub date:Sun May 03 04:00:00 UTC 2020

Copy to clipboard


                    
@article{osti_1695899,

  title        = {Materials Data on FeSb(ClO)8 by Materials Project},

  
  abstractNote = {FeCl2(O)4SbCl6(O2)2 crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one dichloroiron;tetrahydrate molecule, four water molecules, and one SbCl6 cluster. In the SbCl6 cluster, Sb is bonded in an octahedral geometry to six Cl atoms. There are two shorter (2.36 Å) and four longer (2.44 Å) Sb–Cl bond lengths. There are two inequivalent Cl sites. In the first Cl site, Cl is bonded in a single-bond geometry to one Sb atom. In the second Cl site, Cl is bonded in a single-bond geometry to one Sb atom.},

  doi          = {10.17188/1695899},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1695899

Save / Share:

Export Metadata

Save to My Library

Similar records in DOE Data Explorer and OSTI.GOV collections:

Materials Data on FeSb(ClO)8 by Materials Project

Dataset

FeCl2(O)4Sb(OCl3)2O2 crystallizes in the triclinic P1 space group. The structure is one-dimensional and consists of one hydrogen peroxide molecule; one FeCl2(O)4 cluster; and one Sb(OCl3)2 ribbon oriented in the (1, 0, 0) direction. In the FeCl2(O)4 cluster, Fe is bonded in a 6-coordinate geometry to four O and two Cl atoms. There are a spread of Fe–O bond distances ranging from 1.83–2.14 Å. There are one shorter (2.28 Å) and one longer (2.29 Å) Fe–Cl bond lengths. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Fe atom. Inmore »« less
Materials Data on FeSb by Materials Project

Dataset

FeSb is Tungsten Carbide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Fe3+ is bonded to six equivalent Sb3- atoms to form a mixture of face, edge, and corner-sharing FeSb6 octahedra. The corner-sharing octahedral tilt angles are 52°. All Fe–Sb bond lengths are 2.64 Å. Sb3- is bonded in a 6-coordinate geometry to six equivalent Fe3+ atoms.
Materials Data on FeSbS by Materials Project

Dataset

FeSbS crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Fe3+ is bonded to three equivalent Sb1- and three equivalent S2- atoms to form distorted FeSb3S3 octahedra that share corners with eight equivalent FeSb3S3 octahedra, corners with three equivalent SbFe3S tetrahedra, corners with three equivalent SFe3Sb tetrahedra, and edges with two equivalent FeSb3S3 octahedra. The corner-sharing octahedra tilt angles range from 49–63°. There are a spread of Fe–Sb bond distances ranging from 2.55–2.60 Å. There are a spread of Fe–S bond distances ranging from 2.21–2.26 Å. Sb1- is bonded to three equivalent Fe3+ and one S2- atom tomore »« less
Materials Data on ClO by Materials Project

Dataset

ClO is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is zero-dimensional and consists of one hydrochloric acid molecule and one water molecule.
Materials Data on ClO by Materials Project

Dataset

ClO is alpha carbon monoxide-like structured and crystallizes in the tetragonal I4_1/amd space group. The structure is zero-dimensional and consists of eight chlorine molecules and eight hydrogen peroxide molecules.

Similar Records