Dataset

X-ray diffraction (XRD)

dataset for X-ray diffraction (XRD)

Chemical Info

molecular Image
InChI InChI=1S/C13H10N2O3/c1-8(16)14-7-12(17)15-10-5-3-2-4-9(10)6-11(15)13(14)18/h2-6H,7H2,1H3
SMILES CC(=O)N1CC(=O)n2c(C1=O)cc1c2cccc1
InChI Key XEFPBGSACIWODS-UHFFFAOYSA-N
Molecular Formula C13H10N2O3
Exact Mass 242.230 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XEFPBGSACIWODS-UHFFFAOYSA-N/CHMO0000156
License URL
Source https://www.chemotion-repository.net/inchikey/XEFPBGSACIWODS-UHFFFAOYSA-N/CHMO0000156
Version
Author Martin Nieger
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-09-19
Related Molecule
  • 2-acetyl-3H-pyrazino[1,2-a]indole-1,4-dione
    • Field Value
    Measurement Technique X-ray diffraction
    Measurement Variables
    Data-Source Molecule ID Data-Source
    164889741 PubChem
    The data in this table is sourced from UniChem at EBI.