Int-7
DOI: 10.14469/hpc/12132 Metadata
Created: 2022-12-23 13:51
Last modified: 2022-12-23 14:00
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Int-7
Embargo
Access code: vpch-6e7q
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| Int-7.chk | 66MB | chemical/x-gaussian-checkpoint | |
| Int-7.com | 3KB | application/x-msdos-program | |
| Int-7.log | 4MB | chemical/x-gaussian-log |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/12036 | DFT computational data |
Subject Keywords
| Keyword | Value |
|---|---|
| inchi | InChI=1S/C15H15N2O.C2H4O2.CH3O2S.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;1-4(2)3;/h3-8,10-11H,1-2H3,(H-,16,17,18);3H,1H3;1H3;/q2*-1;;+3/p-1 |
| inchikey | KDSVSRBQJLFRQG-UHFFFAOYSA-M |