C 2 H 6

DSpace/Manakin Repository

C 2 H 6

dc.contributor Edward Moore
dc.creator Edward Moore
dc.date.accessioned 2009-12-07T16:33:02Z
dc.date.available 2009-12-07T16:33:02Z
dc.date.issued 2009-12-07T16:33:02Z
dc.identifier No identifier
dc.identifier InChI=1/C2H6/c1-2/h1-2H3
dc.identifier InChIKey=OTMSDBZUPAUEDD-UHFFFAOYSA-N
dc.identifier.uri http://hdl.handle.net/10042/to-3311
dc.description.uri No project
dc.description.uri No description
dc.format.extent 690 bytes
dc.format.extent 67170 bytes
dc.format.extent 46468 bytes
dc.format.extent 1047 bytes
dc.format.extent 62 bytes
dc.format.extent 3 bytes
dc.format.extent 0 bytes
dc.format.extent 11 bytes
dc.format.extent 15 bytes
dc.format.extent 2996 bytes
dc.format.extent 4181 bytes
dc.format.extent 13242 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 Edward Moore
dc.subject.ddc InChI=1/C2H6/c1-2/h1-2H3
dc.subject.ddc InChIKey=OTMSDBZUPAUEDD-UHFFFAOYSA-N
dc.subject.ddc CC
dc.subject.ddc CX1-14-33-2
dc.subject.ddc FOpt
dc.subject.ddc RB3LYP
dc.subject.ddc 3-21G
dc.subject.ddc EM64L-G09RevA.02
dc.subject.ddc 1-A
dc.subject.ddc -79.4006382
dc.subject.ddc 8.759e-10
dc.subject.ddc 6.082e-04
dc.subject.ddc X(C2H6)
dc.subject.ddc CX1-14-33-2
dc.subject.ddc Freq
dc.subject.ddc RB3LYP
dc.subject.ddc 3-21G
dc.subject.ddc Check
dc.subject.ddc EM64L-G09RevA.02
dc.subject.ddc 1-A
dc.subject.ddc -79.4006382
dc.subject.ddc 9.658e-11
dc.subject.ddc 6.082e-04
dc.subject.ddc 22.5252477,-0.0001601,21.0913871,-0.0001035,0.0002208,21.0905432
dc.subject.ddc X(C2H6)
dc.title C 2 H 6
dc.type Gaussian job archive


Files in this item

Files Size Format View
input.gjf 690bytes chemical/x-gaussian-input View/Open
logfile.out 65.59Kb chemical/x-gaussian-log View/Open
checkpoint.fchk 45.37Kb chemical/x-gaussian-checkpoint View/Open
cml.xml 1.022Kb chemical/x-cml View/Open
inchi.txt 62bytes chemical/x-inchi View/Open
smiles.txt 3bytes chemical/x-smiles View/Open
wavefunction.wfn 0bytes Unknown View/Open
project.txt 11bytes Text file View/Open
description.txt 15bytes Text file View/Open
archive-cml-1.xml 2.925Kb chemical/x-cml View/Open
archive-cml-2.xml 4.083Kb chemical/x-cml View/Open

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