Dataset

proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)

dataset for proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)

Chemical Information

molecular Image
InChI InChI=1S/C24H19N5.C2H3N.Cu.F6P/c1-3-9-19(10-4-1)21-14-17-28(26-21)24(23-13-7-8-16-25-23)29-18-15-22(27-29)20-11-5-2-6-12-20;1-2-3;;1-7(2,3,4,5)6/h1-18,24H;1H3;;/q;;+1;-1
SMILES c1ccc(cc1)c1ccn(n1)C(n1ccc(n1)c1ccccc1)c1ccccn1.F[P-](F)(F)(F)(F)F.CC#N.[Cu+]
InChI Key AXGNYRCNCNZKKZ-UHFFFAOYSA-N
Molecular Formula C26H22CuF6N6P
Exact Mass 627.003 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AXGNYRCNCNZKKZ-UHFFFAOYSA-N/CHMO0000889
License URL
Source https://www.chemotion-repository.net/inchikey/AXGNYRCNCNZKKZ-UHFFFAOYSA-N/CHMO0000889
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-27
Related Molecule
  • acetonitrile;2-[bis(3-phenylpyrazol-1-yl)methyl]pyridine;copper(1+);hexafluorophosphate
    • Field Value
    Measurement Technique proton-decoupled 31P nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145944169 PubChem
    168343995 PubChem
    The data in this table is sourced from UniChem at EBI.