Geometry & MOs

Info

ID:	165312
PubChem CID:	74530306
Reduced:	SN2O4H18C23 (1)
Stoich.:	AB2C4D18E23 (1)
Weight, g/mol:	369.078327
ΔH_f, kcal/mol:	-76.36
Dipole, Da:	8.36
IP(EA), eV:	-9.28(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-ethyl-4-oxo-5-(pyridin-2-ylmethylidene)-1,3-thiazolidin-2-ylidene]amino]-2-hydroxybenzoic acid

Drug info:

PubChemData

Smile

CCN1C(=O)C(=CC2=CC=CC3=CC=CC=C32)SC1=NC4=CC(=C(C=C4)C(=O)O)O

DOS

IR

Vibrations