Int-8
DOI: 10.14469/hpc/12133 Metadata
Created: 2022-12-23 13:53
Last modified: 2022-12-23 14:00
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Int-8
Embargo
Access code: znpk-4gpz
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| Int-8.chk | 76MB | chemical/x-gaussian-checkpoint | |
| Int-8.com | 3KB | application/x-msdos-program | |
| Int-8.log | 3MB | chemical/x-gaussian-log |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/12036 | DFT computational data |
Subject Keywords
| Keyword | Value |
|---|---|
| inchi | InChI=1S/C16H18N2O3S.C2H4O2.Cu/c1-16(2,18-11-12-7-6-10-17-15(12)19)13-8-4-5-9-14(13)22(3,20)21;1-2(3)4;/h4-11H,1-3H3,(H-,17,18,19);3H,1H3;/q2*-1;+3/p-1 |
| inchikey | UWEOPBHJVIETFO-UHFFFAOYSA-M |