Dataset
19F nuclear magnetic resonance spectroscopy (19F NMR)
Chemical Information
| InChI | InChI=1S/C23H24NP.2C18H12F3P.2Cu.2HI/c1-3-11-21(12-4-1)25(22-13-5-2-6-14-22)23-18-20(15-16-24-23)17-19-9-7-8-10-19;2*19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18;;;;/h1-6,11-16,18-19H,7-10,17H2;2*1-12H;;;2*1H/q;;;2*+1;;/p-2 |
|---|---|
| SMILES | C1CCC(C1)Cc1ccnc(c1)P(c1ccccc1)c1ccccc1.Fc1ccc(cc1)P(c1ccc(cc1)F)c1ccc(cc1)F.Fc1ccc(cc1)P(c1ccc(cc1)F)c1ccc(cc1)F.[Cu]I.[Cu]I |
| InChI Key | ARNRBIXDBKLRJX-UHFFFAOYSA-L |
| Molecular Formula | C59H48Cu2F6I2NP3 |
| Exact Mass | 1358.832 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/ARNRBIXDBKLRJX-UHFFFAOYSA-L/CHMO0000597 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/ARNRBIXDBKLRJX-UHFFFAOYSA-L/CHMO0000597 |
| Version | |
| Author | Olaf Fuhr |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2020-04-10 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | 19F nuclear magnetic resonance spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 146019169 | PubChem |
| The data in this table is sourced from UniChem at EBI. | |