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Title: Materials Data on H8PtN2(ClO)2 by Materials Project

Abstract

PtN2H8(OCl)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two azane;dichloroplatinum(2+);dihydrate molecules. Pt4+ is bonded in an octahedral geometry to two equivalent N3-, two equivalent O2-, and two equivalent Cl1- atoms. Both Pt–N bond lengths are 2.07 Å. Both Pt–O bond lengths are 2.05 Å. Both Pt–Cl bond lengths are 2.34 Å. N3- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and three H1+ atoms. There are a spread of N–H bond distances ranging from 1.03–1.05 Å. There are four inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom. Cl1- is bonded in a single-bond geometry to one Pt4+ atom.

Publication Date:
Other Number(s):
mp-23858
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; H8PtN2(ClO)2; Cl-H-N-O-Pt
OSTI Identifier:
1199766
DOI:
https://doi.org/10.17188/1199766

Citation Formats

The Materials Project. Materials Data on H8PtN2(ClO)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1199766.
The Materials Project. Materials Data on H8PtN2(ClO)2 by Materials Project. United States. doi:https://doi.org/10.17188/1199766
The Materials Project. 2020. "Materials Data on H8PtN2(ClO)2 by Materials Project". United States. doi:https://doi.org/10.17188/1199766. https://www.osti.gov/servlets/purl/1199766. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1199766,
title = {Materials Data on H8PtN2(ClO)2 by Materials Project},
author = {The Materials Project},
abstractNote = {PtN2H8(OCl)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two azane;dichloroplatinum(2+);dihydrate molecules. Pt4+ is bonded in an octahedral geometry to two equivalent N3-, two equivalent O2-, and two equivalent Cl1- atoms. Both Pt–N bond lengths are 2.07 Å. Both Pt–O bond lengths are 2.05 Å. Both Pt–Cl bond lengths are 2.34 Å. N3- is bonded in a distorted trigonal non-coplanar geometry to one Pt4+ and three H1+ atoms. There are a spread of N–H bond distances ranging from 1.03–1.05 Å. There are four inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. O2- is bonded in a distorted single-bond geometry to one Pt4+ and one H1+ atom. Cl1- is bonded in a single-bond geometry to one Pt4+ atom.},
doi = {10.17188/1199766},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}