IR Data for Sample 58.
DOI: 10.14469/hpc/11509 Metadata
Created: 2022-10-24 17:46
Last modified: 2024-05-28 16:00
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
IR data for Bis(ethanol) bis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)nickel (58)
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| 58.png | 76KB | image/png | Image representation |
| TM-VI-203_2021-12-05T19-15-17.pdf | 63KB | application/pdf | IR Spectrum as PDF |
| 58.cdxml | 14KB | chemical/x-cdxml | Chemdraw connection table |
| 58.mol | 4KB | chemical/x-mdl-molfile | MDL Molfile |
| 58.cdxml | 14KB | chemical/x-cdxml | Chemdraw connection table v2 |
| 58.png | 54KB | image/png | Image representation v2 |
| 58.mol | 2KB | chemical/x-mdl-molfile | MDL Molfile v2 |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/11404 | Compound 58: bis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy) |
Subject Keywords
| Keyword | Value |
|---|---|
| IFD.IR | IR Spectrum |
| inchi | InChI=1S/2C12H12N2O3.2C2H6O.Ni/c2*1-2-17-12(16)10-8-13-14(11(10)15)9-6-4-3-5-7-9;2*1-2-3;/h2*3-8,15H,2H2,1H3;2*3H,2H2,1H3;/q;;;;+2/p-2 |
| inchikey | RGMTWOPWBSZVQF-UHFFFAOYSA-L |
| SMILES | [H]O(CC)[Ni]12(OC3=C(C(OCC)=O1)C=NN3C4=CC=CC=C4)(O([H])CC)OC5=C(C(OCC)=O2)C=NN5C6=CC=CC=C6 |