Dataset

attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

dataset for attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)

Chemical Information

molecular Image
InChI InChI=1S/C16H24N6.2ClH.Fe/c1-19-9-10-20(2)15(19)17-13-7-5-6-8-14(13)18-16-21(3)11-12-22(16)4;;;/h5-8H,9-12H2,1-4H3;2*1H;/q;;;+2/p-2
SMILES CN1CCN(C1=Nc1ccccc1N=C1N(C)CCN1C)C.Cl[Fe]Cl
InChI Key LGNUUDHCCJBFIW-UHFFFAOYSA-L
Molecular Formula C16H24Cl2FeN6
Exact Mass 427.153 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LGNUUDHCCJBFIW-UHFFFAOYSA-L/CHMO0000763
License URL
Source https://www.chemotion-repository.net/inchikey/LGNUUDHCCJBFIW-UHFFFAOYSA-L/CHMO0000763
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-09-18
Related Molecule
  • dichloroiron;N-[2-[(1,3-dimethylimidazolidin-2-ylidene)amino]phenyl]-1,3-dimethylimidazolidin-2-imine
    • Field Value
    Measurement Technique attenuated total reflectance Fourier transform infrared spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    168499158 PubChem
    The data in this table is sourced from UniChem at EBI.