Geometry & MOs

Info

ID:	123561
PubChem CID:	50854169
Reduced:	NO2H17C19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	355.115462
ΔH_f, kcal/mol:	-10.25
Dipole, Da:	4.69
IP(EA), eV:	-8.94(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[(1-cyclopentylpyrrol-3-yl)methylidene]-2-(4-fluoroanilino)-1,3-thiazol-4-one

Drug info:

PubChemData

Smile

C1CCC(C1)N2C=CC(=C2)C=C3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations