XYZ coordinates

DOI: 10.14469/hpc/12076 Metadata

Created: 2022-12-21 13:00

Last modified: 2022-12-21 14:00

Author: Joe I. Higham

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Coordinates

Embargo

Access code: pr9q-ufuf

Release embargo

Files

FilenameSizeTypeDescription
coordinates.xyz 29KB chemical/x-xyz Coordinates

Member of collection / collaboration

DOIDescription
10.14469/hpc/12036 DFT computational data

Subject Keywords

KeywordValue
inchi InChI=1S/C9H13N.C2H4O2.Cu/c1-9(2,10)8-6-4-3-5-7-8;1-2(3)4;/h3-7H,10H2,1-2H3;1H3,(H,3,4);/q;;+1/p-1
inchikey MTZWVASFINEIKM-UHFFFAOYSA-M

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