C 1 O 1

DSpace/Manakin Repository

C 1 O 1

dc.contributor Henry S Rzepa
dc.date.accessioned 2011-08-28T14:42:20Z
dc.date.available 2011-08-28T14:42:20Z
dc.date.issued 2011-08-28T14:42:20Z
dc.identifier InChI=1/CH2O/c1-2/h1H2
dc.identifier InChIKey=WSFSSNUMVMOOMR-UHFFFAOYSA-N
dc.identifier.uri http://hdl.handle.net/10042/to-9302
dc.identifier.uri http://dx.doi.org/10.14469/ch/9276
dc.description.uri blog
dc.description.uri CO
dc.format.extent 3156 bytes
dc.format.extent 63348 bytes
dc.format.extent 250750 bytes
dc.format.extent 352 bytes
dc.format.extent 60 bytes
dc.format.extent 4 bytes
dc.format.extent 0 bytes
dc.format.extent 4 bytes
dc.format.extent 3 bytes
dc.format.extent 2279 bytes
dc.format.extent 2675 bytes
dc.format.extent 13396 bytes
dc.format.mimetype chemical/x-gaussian-input
dc.format.mimetype chemical/x-gaussian-log
dc.format.mimetype chemical/x-gaussian-checkpoint
dc.format.mimetype chemical/x-cml
dc.format.mimetype chemical/x-inchi
dc.format.mimetype chemical/x-smiles
dc.format.mimetype application/octet-stream
dc.format.mimetype text/plain
dc.format.mimetype text/plain
dc.format.mimetype chemical/x-cml
dc.format.mimetype chemical/x-cml
dc.format.mimetype application/xml
dc.language.iso en_US
dc.publisher Imperial College London
dc.rights.uri Henry S Rzepa
dc.subject.ddc InChI=1/CH2O/c1-2/h1H2
dc.subject.ddc InChIKey=WSFSSNUMVMOOMR-UHFFFAOYSA-N
dc.subject.ddc C=O
dc.subject.ddc CX1-15-35-2
dc.subject.ddc FOpt
dc.subject.ddc RmPW1PW91
dc.subject.ddc Gen
dc.subject.ddc cpcm
dc.subject.ddc EM64L-G09RevB.01
dc.subject.ddc 1-SG
dc.subject.ddc -113.3197234
dc.subject.ddc 4.727e-09
dc.subject.ddc 1.118e-05
dc.subject.ddc C*(C1O1)
dc.subject.ddc CX1-15-35-2
dc.subject.ddc Freq
dc.subject.ddc RmPW1PW91
dc.subject.ddc Gen
dc.subject.ddc Check
dc.subject.ddc EM64L-G09RevB.01
dc.subject.ddc 1-SG
dc.subject.ddc -113.3197234
dc.subject.ddc 4.422e-10
dc.subject.ddc 1.119e-05
dc.subject.ddc 13.7326732,0.,13.7326732,0.,0.,17.818347
dc.subject.ddc C*(C1O1)
dc.title C 1 O 1
dc.type Gaussian job archive


Files in this item

Files Size Format View
input.gjf 3.082Kb chemical/x-gaussian-input View/Open
logfile.out 61.86Kb chemical/x-gaussian-log View/Open
checkpoint.fchk 244.8Kb chemical/x-gaussian-checkpoint View/Open
cml.xml 352bytes chemical/x-cml View/Open
inchi.txt 60bytes chemical/x-inchi View/Open
smiles.txt 4bytes chemical/x-smiles View/Open
wavefunction.wfn 0bytes chemical/x-wavefunction View/Open
project.txt 4bytes Text file View/Open
description.txt 3bytes Text file View/Open
archive-cml-1.xml 2.225Kb chemical/x-cml View/Open
archive-cml-2.xml 2.612Kb chemical/x-cml View/Open

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