C 6 H 6 -2

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C 6 H 6 -2

dc.contributor Henry S Rzepa
dc.date.accessioned 2012-12-08T08:15:11Z
dc.date.available 2012-12-08T08:15:11Z
dc.date.issued 2012-12-08
dc.identifier InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
dc.identifier InChIKey=UHOVQNZJYSORNB-UHFFFAOYSA-N
dc.identifier.uri http://hdl.handle.net/10042/22261
dc.identifier.uri http://dx.doi.org/10.14469/ch/16222
dc.description 2nd_year
dc.description benzene di-anion
dc.publisher Imperial College London
dc.rights Henry S Rzepa
dc.title C 6 H 6 -2
dc.type Gaussian job archive


Files in this item

Files Size Format View
input.gjf 888bytes chemical/x-gaussian-input View/Open
logfile.log 162.5Kb chemical/x-gaussian-log View/Open
checkpoint.fchk 713.6Kb chemical/x-gaussian-checkpoint View/Open
cml.xml 1.547Kb chemical/x-cml View/Open
inchi.txt 72bytes chemical/x-inchi View/Open
smiles.txt 17bytes chemical/x-smiles View/Open
wavefunction.wfn 0bytes chemical/x-wavefunction View/Open
project.txt 8bytes Text file View/Open
description.txt 16bytes Text file View/Open
archive-cml-1.xml 3.800Kb chemical/x-cml View/Open
archive-cml-2.xml 5.159Kb chemical/x-cml View/Open

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