U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Fe2(CO)9 by Materials Project
Abstract
Fe2(CO)9 crystallizes in the hexagonal P6_3/m space group. The structure is zero-dimensional and consists of six formaldehyde molecules and four Fe(CO)3 clusters. In each Fe(CO)3 cluster, Fe3+ is bonded in a 3-coordinate geometry to three equivalent C+1.33+ atoms. All Fe–C bond lengths are 1.82 Å. C+1.33+ is bonded in a distorted single-bond geometry to one Fe3+ and one O2- atom. The C–O bond length is 1.16 Å. O2- is bonded in a single-bond geometry to one C+1.33+ atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-643081
- 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; Fe2(CO)9; C-Fe-O
- OSTI Identifier:
- 1280259
- DOI:
- https://doi.org/10.17188/1280259
Citation Formats
The Materials Project. Materials Data on Fe2(CO)9 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1280259.
The Materials Project. Materials Data on Fe2(CO)9 by Materials Project. United States. doi:https://doi.org/10.17188/1280259
The Materials Project. 2020.
"Materials Data on Fe2(CO)9 by Materials Project". United States. doi:https://doi.org/10.17188/1280259. https://www.osti.gov/servlets/purl/1280259. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1280259,
title = {Materials Data on Fe2(CO)9 by Materials Project},
author = {The Materials Project},
abstractNote = {Fe2(CO)9 crystallizes in the hexagonal P6_3/m space group. The structure is zero-dimensional and consists of six formaldehyde molecules and four Fe(CO)3 clusters. In each Fe(CO)3 cluster, Fe3+ is bonded in a 3-coordinate geometry to three equivalent C+1.33+ atoms. All Fe–C bond lengths are 1.82 Å. C+1.33+ is bonded in a distorted single-bond geometry to one Fe3+ and one O2- atom. The C–O bond length is 1.16 Å. O2- is bonded in a single-bond geometry to one C+1.33+ atom.},
doi = {10.17188/1280259},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Sun May 03 00:00:00 EDT 2020},
month = {Sun May 03 00:00:00 EDT 2020}
}
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