Geometry & MOs

Info

ID:	297413
PubChem CID:	117617013
Reduced:	SN2O3H20C21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	364.088164
ΔH_f, kcal/mol:	-40.23
Dipole, Da:	2.35
IP(EA), eV:	-8.72(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-2-cyclopropylimino-3-phenyl-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CCN=C1N(C(=O)/C(=C/C2=CC3=C(C=C2)OCCO3)/S1)C4=CC=CC=C4C

DOS

IR

Vibrations