Geometry & MOs

Info

ID:	223429
PubChem CID:	85335032
Reduced:	S2N3O4H9C14 (1)
Stoich.:	A2B3C4D9E14 (1)
Weight, g/mol:	347.987464
ΔH_f, kcal/mol:	-53.7
Dipole, Da:	6.76
IP(EA), eV:	-9.16(-2.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]sulfanylpyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)SC2=CC=C(O2)C=C3C(=O)NC(=S)N3)C(=O)O

DOS

IR

Vibrations