Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

dataset for 19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Information

molecular Image
InChI InChI=1S/2C18H12F3P.C18H16NP.2Cu.2HI/c2*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;1-15-12-13-19-18(14-15)20(16-8-4-2-5-9-16)17-10-6-3-7-11-17;;;;/h2*1-12H;2-14H,1H3;;;2*1H/q;;;2*+1;;/p-2
SMILES 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 XHFJIHLNMPUPEE-UHFFFAOYSA-L
Molecular Formula C54H40Cu2F6I2NP3
Exact Mass 1290.715 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XHFJIHLNMPUPEE-UHFFFAOYSA-L/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/XHFJIHLNMPUPEE-UHFFFAOYSA-L/CHMO0000597
Version
Author Olaf Fuhr
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-04-09
Related Molecule
  • iodocopper;(4-methylpyridin-2-yl)-diphenylphosphane;tris(4-fluorophenyl)phosphane
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    146019164 pubchem
    The data in this table is sourced from UniChem at EBI.