C5H4O3

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C5H4O3

dc.contributor Henry S Rzepa
dc.date.accessioned 2012-11-17T08:27:31Z
dc.date.available 2012-11-17T08:27:31Z
dc.date.issued 2012-11-17
dc.identifier InChI=1S/C4H4O2.CO/c1-4(6)2-3-5;1-2/h2H,1H3;
dc.identifier InChIKey=SISVBSTUASYTGH-UHFFFAOYSA-N
dc.identifier.uri http://hdl.handle.net/10042/21671
dc.identifier.uri http://dx.doi.org/10.14469/ch/15632
dc.description Wentrup
dc.description 5 IRC
dc.publisher Imperial College London
dc.rights Henry S Rzepa
dc.title C5H4O3
dc.type Gaussian job archive


Files in this item

Files Size Format View
input.gjf 943bytes chemical/x-gaussian-input View/Open
logfile.log 1.489Mb chemical/x-gaussian-log View/Open
checkpoint.fchk.gz 329.4Kb chemical/x-gaussian-checkpoint View/Open
cml.xml 1.629Kb chemical/x-cml View/Open
inchi.txt 82bytes chemical/x-inchi View/Open
smiles.txt 25bytes chemical/x-smiles View/Open
wavefunction.wfn 0bytes chemical/x-wavefunction View/Open
project.txt 7bytes Text file View/Open
description.txt 5bytes Text file View/Open

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