Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

Chemical Information

molecular Image
InChI InChI=1S/C10H8N2.3CO.ClH.Re/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;3*1-2;;/h1-8H;;;;1H;/q;;;;;+1/p-1
SMILES c1ccc(nc1)c1ccccn1.[C-]#[O+].[C-]#[O+].[C-]#[O+].Cl[Re]
InChI Key JBWAZOJPJGMZEF-UHFFFAOYSA-M
Molecular Formula C13H8ClN2O3Re
Exact Mass 461.874 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JBWAZOJPJGMZEF-UHFFFAOYSA-M/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/JBWAZOJPJGMZEF-UHFFFAOYSA-M/CHMO0001146
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-07-05
Related Molecule
  • carbon monoxide;chlororhenium;2-pyridin-2-ylpyridine
    • Field Value
    Measurement Technique 1H–13C heteronuclear single quantum coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    11294165 PubChem
    155885097 PubChem
    16381831 PubChem: Thomson Pharma
    The data in this table is sourced from UniChem at EBI.