SM-TDG

DOI: 10.14469/hpc/12140 Metadata

Created: 2022-12-23 14:03

Last modified: 2022-12-23 15:00

Author: Joe I. Higham

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

SM-TDG

Embargo

Access code: mpr3-za7w

Release embargo

Files

FilenameSizeTypeDescription
SM-TDG.chk 10MB chemical/x-gaussian-checkpoint
SM-TDG.com 1KB application/x-msdos-program
SM-TDG.log 341KB chemical/x-gaussian-log

Member of collection / collaboration

DOIDescription
10.14469/hpc/12036 DFT computational data

Subject Keywords

KeywordValue
inchi InChI=1S/C6H5NO2/c8-4-5-2-1-3-7-6(5)9/h1-4H,(H,7,9)
inchikey DNTYEVWEOFZXFE-UHFFFAOYSA-N

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