Geometry & MOs

Info

ID:	229836
PubChem CID:	87569330
Reduced:	FeSO4C12H14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	233.064113
ΔH_f, kcal/mol:	3.43
Dipole, Da:	5.52
IP(EA), eV:	-6.69(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-2-methyl-5-pentyl-2H-1,3-thiazole-4-carbaldehyde

Drug info:

PubChemData

Smile

CCO.C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)O.[Fe]

DOS

IR

Vibrations