Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/2C21H12F9P.C17H14NP.2Cu.2HI/c2*22-19(23,24)13-1-7-16(8-2-13)31(17-9-3-14(4-10-17)20(25,26)27)18-11-5-15(6-12-18)21(28,29)30;1-3-9-15(10-4-1)19(16-11-5-2-6-12-16)17-13-7-8-14-18-17;;;;/h2*1-12H;1-14H;;;2*1H/q;;;2*+1;;/p-2
SMILES c1ccc(cc1)P(c1ccccn1)c1ccccc1.FC(c1ccc(cc1)P(c1ccc(cc1)C(F)(F)F)c1ccc(cc1)C(F)(F)F)(F)F.FC(c1ccc(cc1)P(c1ccc(cc1)C(F)(F)F)c1ccc(cc1)C(F)(F)F)(F)F.[Cu]I.[Cu]I
InChI Key PDIAHQRNBMXKST-UHFFFAOYSA-L
Molecular Formula C59H38Cu2F18I2NP3
Exact Mass 1576.733 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PDIAHQRNBMXKST-UHFFFAOYSA-L/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/PDIAHQRNBMXKST-UHFFFAOYSA-L/CHMO0000595
Version
Author Jasmin Busch
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:52:11.304322
MetadataModified 2024-09-07T17:33:41.622201
MetadataPublished 2020-04-10
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables