Geometry & MOs

Info

ID:	161246
PubChem CID:	57391151
Reduced:	FSN2O2H9C14 (1)
Stoich.:	ABC2D2E9F14 (1)
Weight, g/mol:	260.007805
ΔH_f, kcal/mol:	-28.61
Dipole, Da:	6.99
IP(EA), eV:	-8.88(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-(1H-indol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC=C(O2)/C=C\3/C(=O)N=C(S3)N)F

DOS

IR

Vibrations