C6H3MnO5

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C6H3MnO5

dc.contributor Henry S Rzepa
dc.date.accessioned 2012-11-02T08:00:08Z
dc.date.available 2012-11-02T08:00:08Z
dc.date.issued 2012-11-02
dc.identifier InChI=1S/5CO.CH3.Mn/c5*1-2;;/h;;;;;1H3;
dc.identifier InChIKey=KJJLHDHVFFAISC-UHFFFAOYSA-N
dc.identifier.uri http://hdl.handle.net/10042/21486
dc.identifier.uri http://dx.doi.org/10.14469/ch/15447
dc.description 2nd_year
dc.description Mn(CO)5Me + CO singlet IRC
dc.publisher Imperial College London
dc.rights Henry S Rzepa
dc.title C6H3MnO5
dc.type Gaussian job archive


Files in this item

Files Size Format View
input.gjf 1.163Kb chemical/x-gaussian-input View/Open
logfile.log 1.755Mb chemical/x-gaussian-log View/Open
checkpoint.fchk.gz 719.1Kb chemical/x-gaussian-checkpoint View/Open
cml.xml 2.169Kb chemical/x-cml View/Open
inchi.txt 77bytes chemical/x-inchi View/Open
smiles.txt 46bytes chemical/x-smiles View/Open
wavefunction.wfn 0bytes chemical/x-wavefunction View/Open
project.txt 8bytes Text file View/Open
description.txt 26bytes Text file View/Open

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