Geometry & MOs

Info

ID:	123558
PubChem CID:	50854152
Reduced:	SO2N3C20H21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	365.156184
ΔH_f, kcal/mol:	0.71
Dipole, Da:	5.03
IP(EA), eV:	-8.33(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[(1-cyclopentylpyrrol-3-yl)methylidene]-3-ethyl-2-phenylimino-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC2=NC(=O)/C(=C\C3=CN(C=C3)C4CCCC4)/S2

DOS

IR

Vibrations