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/C35H28N6.C2H3N.Cu.F6P/c1-39-23-22-36-34(39)35(40-32(28-18-10-4-11-19-28)24-30(37-40)26-14-6-2-7-15-26)41-33(29-20-12-5-13-21-29)25-31(38-41)27-16-8-3-9-17-27;1-2-3;;1-7(2,3,4,5)6/h2-25,35H,1H3;1H3;;/q;;+1;-1
SMILES F[P-](F)(F)(F)(F)F.Cn1ccnc1C(n1nc(cc1c1ccccc1)c1ccccc1)n1nc(cc1c1ccccc1)c1ccccc1.CC#N.[Cu+]
InChI Key MHRJPVSEKXPPCE-UHFFFAOYSA-N
Molecular Formula C37H31CuF6N7P
Exact Mass 782.199 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MHRJPVSEKXPPCE-UHFFFAOYSA-N/CHMO0000889
License URL
Source https://www.chemotion-repository.net/inchikey/MHRJPVSEKXPPCE-UHFFFAOYSA-N/CHMO0000889
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-27
Related Molecule
  • acetonitrile;copper(1+);1-[(3,5-diphenylpyrazol-1-yl)-(1-methylimidazol-2-yl)methyl]-3,5-diphenylpyrazole;hexafluorophosphate
    • Field Value
    Measurement Technique proton-decoupled 31P nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145944168 PubChem
    The data in this table is sourced from UniChem at EBI.