Dataset

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

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

Chemical Info

molecular Image
InChI InChI=1S/C36H26ClN5.C2H3N.Cu.F6P/c37-30-21-22-38-33(23-30)36(41-34(28-17-9-3-10-18-28)24-31(39-41)26-13-5-1-6-14-26)42-35(29-19-11-4-12-20-29)25-32(40-42)27-15-7-2-8-16-27;1-2-3;;1-7(2,3,4,5)6/h1-25,36H;1H3;;/q;;+1;-1
SMILES F[P-](F)(F)(F)(F)F.Clc1ccnc(c1)C(n1nc(cc1c1ccccc1)c1ccccc1)n1nc(cc1c1ccccc1)c1ccccc1.CC#N.[Cu+]
InChI Key ZXFVPDKZHCLOHM-UHFFFAOYSA-N
Molecular Formula C38H29ClCuF6N6P
Exact Mass 813.640 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZXFVPDKZHCLOHM-UHFFFAOYSA-N/CHMO0000889
License URL
Source https://www.chemotion-repository.net/inchikey/ZXFVPDKZHCLOHM-UHFFFAOYSA-N/CHMO0000889
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T02:26:51.640068
MetadataModified 2024-09-07T16:59:12.608065
MetadataPublished 2020-02-27
Field Value
Measurement Technique proton-decoupled 31P nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
145944166 PubChem
The data in this table is sourced from UniChem at EBI.