Dataset

X-ray diffraction (XRD)

dataset for X-ray diffraction (XRD)

Chemical Info

molecular Image
InChI InChI=1S/3C9H6O6.2C2H4O2.6Cu/c3*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;2*1-2(3)4;;;;;;/h3*1-3H,(H,10,11)(H,12,13)(H,14,15);2*1H3,(H,3,4);;;;;;/q;;;;;;5*+1/p-7
SMILES [O-]C(=O)C.[O-]C(=O)C.[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O)C(=O)O[Cu][Cu]OC(=O)c1cc(cc(c1)C(=O)O)C(=O)O
InChI Key IHUUETIJADXDFP-UHFFFAOYSA-G
Molecular Formula C31H19Cu6O22-2
Exact Mass 1109.711 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IHUUETIJADXDFP-UHFFFAOYSA-G/CHMO0000156.17
License URL
Source https://www.chemotion-repository.net/inchikey/IHUUETIJADXDFP-UHFFFAOYSA-G/CHMO0000156.17
Version
Author Lena Pilz
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-03-15
Related Molecule
  • nfdi4chem-mol8437 (Unknown Molecule)
    • Field Value
    Measurement Technique X-ray diffraction
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.