Crystal structure data for Compound 19 Bis(ethanol) bis(4-(ethoxycarbonyl)-1-(4-methoxybenzyl)-1H-pyrazol-5-olate)calcium
DOI: 10.14469/hpc/11346 Metadata
Created: 2022-10-09 18:29
Last modified: 2024-06-27 17:00
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Primary crystal structure data for Bis(ethanol) bis(4-(ethoxycarbonyl)-1-(4-methoxybenzyl)-1H-pyrazol-5-olate)calcium (19)
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| AB2119.cif | 706KB | chemical/x-cif | CIF processed data |
| AB2119.7z | 927MB | application/x-7z-compressed | g7z archive of primary crystal structure data |
| AB2119.tar.gz | 949MB | application/gzip | gzip archive of primary crystal structure data |
| 19.cdxml | 19KB | chemical/x-cdxml | Chemdraw connection table |
| 19.png | 43KB | image/png | I,mage structure representatio |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/11343 | Compound 19: bis(4-(ethoxycarbonyl)-1-(4-methoxybenzyl)-1H-pyrazol-5-olate)calcium |
Associated DOIs
| Current dataset ... | DOI | Description |
|---|---|---|
| References | 10.5517/ccdc.csd.cc2d6r9p | CSD Entry: VIPBAB |
| isReferencedBy | 10.5517/ccdc.csd.cc2d6r9p | CSD Entry: VIPBAB |
Subject Keywords
| Keyword | Value |
|---|---|
| IFD.XRAY | Crystal structure |
| inchi | InChI=1S/2C14H16N2O4.2C2H6O.Ca/c2*1-3-20-14(18)12-8-15-16(13(12)17)9-10-4-6-11(19-2)7-5-10;2*1-2-3;/h2*4-8,17H,3,9H2,1-2H3;2*3H,2H2,1H3;/q;;;;+2/p-2 |
| inchikey | COXUFEKBFOSEFD-UHFFFAOYSA-L |