IR Data for Compound 34.
DOI: 10.14469/hpc/11616 Metadata
Created: 2022-10-26 20:17
Last modified: 2024-04-01 13:42
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
IR Data for Tetrakis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)zirconium (34)
Files
Filename | Size | Type | Description |
---|---|---|---|
TM-VI-137_2021-10-27T13-30-32.pdf | 60KB | application/pdf | IR spectrum as PDF |
34.png | 45KB | image/png | Image structure representation |
34.cdxml | 20KB | chemical/x-cdxml | Chemdraw connection table |
34.mol | 7KB | chemical/x-mdl-molfile | MDL Molfile |
Member of collection / collaboration
DOI | Description |
---|---|
10.14469/hpc/11373 | Compound 34: Tetrakis((4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl)oxy)zirconium |
Subject Keywords
Keyword | Value |
---|---|
IFD.IR | IR Spectrum |
inchi | InChI=1S/4C12H12N2O3.Zr/c4*1-2-17-12(16)10-8-13-14(11(10)15)9-6-4-3-5-7-9;/h4*3-8,15H,2H2,1H3;/q;;;;+4/p-4 |
inchikey | UANOGLBNQFBPFY-UHFFFAOYSA-J |
SMILES | CCOC(C1=C(O2)N(C3=CC=CC=C3)N=C1)=O[Zr]4256(O=C(OCC)C7=C(O5)N(C8=CC=CC=C8)N=C7)(O=C(OCC)C9=C(O6)N(C%10=CC=CC=C%10)N=C9)OC%11=C(C(OCC)=O4)C=NN%11C%12=CC=CC=C%12 |