U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Co4Si(CO)14 by Materials Project
Abstract
(Co(CO)4)2(Co(CO)3)2Si crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight akos016035116 molecules, four silicon molecules, and eight Co(CO)4 clusters. In each Co(CO)4 cluster, Co2+ is bonded in a 4-coordinate geometry to four C+1.14+ atoms. There are a spread of Co–C bond distances ranging from 1.76–1.92 Å. There are four inequivalent C+1.14+ sites. In the first C+1.14+ site, C+1.14+ is bonded in a linear geometry to one Co2+ and one O2- atom. The C–O bond length is 1.16 Å. In the second C+1.14+ site, C+1.14+ is bonded in a distorted single-bond geometry to one Co2+ and one O2- atom. The C–O bond length is 1.18 Å. In the third C+1.14+ site, C+1.14+ is bonded in a linear geometry to one Co2+ and one O2- atom. The C–O bond length is 1.15 Å. In the fourth C+1.14+ site, C+1.14+ is bonded in a linear geometry to one Co2+ and one O2- atom. The C–O bond length is 1.15 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one C+1.14+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one C+1.14+more »
- Authors:
- Publication Date:
- Other Number(s):
- mp-651279
- 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; Co4Si(CO)14; C-Co-O-Si
- OSTI Identifier:
- 1281054
- DOI:
- https://doi.org/10.17188/1281054
Citation Formats
The Materials Project. Materials Data on Co4Si(CO)14 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1281054.
The Materials Project. Materials Data on Co4Si(CO)14 by Materials Project. United States. doi:https://doi.org/10.17188/1281054
The Materials Project. 2020.
"Materials Data on Co4Si(CO)14 by Materials Project". United States. doi:https://doi.org/10.17188/1281054. https://www.osti.gov/servlets/purl/1281054. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1281054,
title = {Materials Data on Co4Si(CO)14 by Materials Project},
author = {The Materials Project},
abstractNote = {(Co(CO)4)2(Co(CO)3)2Si crystallizes in the monoclinic C2/c space group. The structure is zero-dimensional and consists of eight akos016035116 molecules, four silicon molecules, and eight Co(CO)4 clusters. In each Co(CO)4 cluster, Co2+ is bonded in a 4-coordinate geometry to four C+1.14+ atoms. There are a spread of Co–C bond distances ranging from 1.76–1.92 Å. There are four inequivalent C+1.14+ sites. In the first C+1.14+ site, C+1.14+ is bonded in a linear geometry to one Co2+ and one O2- atom. The C–O bond length is 1.16 Å. In the second C+1.14+ site, C+1.14+ is bonded in a distorted single-bond geometry to one Co2+ and one O2- atom. The C–O bond length is 1.18 Å. In the third C+1.14+ site, C+1.14+ is bonded in a linear geometry to one Co2+ and one O2- atom. The C–O bond length is 1.15 Å. In the fourth C+1.14+ site, C+1.14+ is bonded in a linear geometry to one Co2+ and one O2- atom. The C–O bond length is 1.15 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one C+1.14+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one C+1.14+ atom. In the third O2- site, O2- is bonded in a single-bond geometry to one C+1.14+ atom. In the fourth O2- site, O2- is bonded in a single-bond geometry to one C+1.14+ atom.},
doi = {10.17188/1281054},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Apr 30 00:00:00 EDT 2020},
month = {Thu Apr 30 00:00:00 EDT 2020}
}