Int-S3

DOI: 10.14469/hpc/12155 Metadata

Created: 2022-12-23 14:37

Last modified: 2022-12-23 15:00

Author: Joe I. Higham

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Int-S3

Embargo

Access code: vnkd-6323

Release embargo

Files

FilenameSizeTypeDescription
Int-S3.chk 84MB chemical/x-gaussian-checkpoint
Int-S3.com 4KB application/x-msdos-program
Int-S3.log 2MB chemical/x-gaussian-log

Member of collection / collaboration

DOIDescription
10.14469/hpc/12154 No TDG calculations

Subject Keywords

KeywordValue
inchi InChI=1S/2C9H13N.2C2H4O2.Cu/c2*1-9(2,10)8-6-4-3-5-7-8;2*1-2(3)4;/h2*3-7H,10H2,1-2H3;2*1H3,(H,3,4);/q;;;;+2/p-2
inchikey SSCBZSYELLXTAC-UHFFFAOYSA-L

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