oClPhB(OMe)2 Single B Catalyst - END Def2svpp
DOI: 10.14469/hpc/11936 Metadata
Created: 2022-11-27 21:20
Last modified: 2022-12-10 13:16
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
PhCOOH + PhCH2NH2
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| opt-tzvpp-ok.log | 3MB | chemical/x-gaussian-log |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/11924 | oClPhB(OH)2 single B catalyst |
Subject Keywords
| Keyword | Value |
|---|---|
| inchi | InChI=1S/C21H21BClNO3.C7H6O2.H2O/c1-26-22(19-14-8-9-15-20(19)23,24-16-17-10-4-2-5-11-17)27-21(25)18-12-6-3-7-13-18;8-7(9)6-4-2-1-3-5-6;/h2-15H,16,24H2,1H3;1-5H,(H,8,9);1H2 |
| inchikey | JXZSHVOZAJYMMN-UHFFFAOYSA-N |