TS-S1-5

DOI: 10.14469/hpc/12144 Metadata

Created: 2022-12-23 14:09

Last modified: 2022-12-23 15:00

Author: Joe I. Higham

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

TS-S1-5

Embargo

Access code: zc6x-yuzz

Release embargo

Files

FilenameSizeTypeDescription
TS-S1-5.chk 54MB chemical/x-gaussian-checkpoint
TS-S1-5.com 3KB application/x-msdos-program
TS-S1-5.log 1MB chemical/x-gaussian-log

Member of collection / collaboration

DOIDescription
10.14469/hpc/12036 DFT computational data

Subject Keywords

KeywordValue
inchi InChI=1S/C15H15N2O.C2H4O2.Cu/c1-15(2,13-8-4-3-5-9-13)17-11-12-7-6-10-16-14(12)18;1-2(3)4;/h3-8,10-11H,1-2H3,(H-,16,17,18);3H,1H3;/q2*-1;+3/p-1
inchikey BYSLHLWSBTXBFK-UHFFFAOYSA-M

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