H22O11

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H22O11

dc.contributor Henry S Rzepa
dc.date.accessioned 2016-04-13T13:39:52Z
dc.date.available 2016-04-13T13:39:52Z
dc.date.issued 2016-04-13
dc.identifier http://www.ch.ic.ac.uk/rzepa/rzepa.xrdf
dc.identifier InChI=1S/10H2O.HO.H/h10*1H2;1H;
dc.identifier InChIKey=WGEHYWFZPMPGLC-UHFFFAOYSA-N
dc.identifier.uri http://hdl.handle.net/10042/196244
dc.identifier.uri http://dx.doi.org/10.14469/ch/191994
dc.description blog
dc.description hydronium hydroxide 6-311++G(d,p) C3 + 9H2O alt
dc.publisher Imperial College London
dc.rights Henry S Rzepa
dc.title H22O11
dc.type Gaussian job archive


Files in this item

Files Size Format View
input.gjf 3.952Kb chemical/x-gaussian-input View/Open
logfile.log 2.577Mb chemical/x-gaussian-log View/Open
checkpoint.fchk 4.029Mb chemical/x-gaussian-checkpoint View/Open
cml.xml 3.515Kb chemical/x-cml View/Open
inchi.txt 69bytes chemical/x-inchi View/Open
smiles.txt 29bytes chemical/x-smiles View/Open
wavefunction.wfn 0bytes Unknown View/Open
project.txt 4bytes Text file View/Open
description.txt 47bytes Text file View/Open

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