Geometry & MOs

Info

ID:	161245
PubChem CID:	57391147
Reduced:	Cl2S2N3O6H13C19 (1)
Stoich.:	A2B2C3D6E13F19 (1)
Weight, g/mol:	288.036877
ΔH_f, kcal/mol:	-167.4
Dipole, Da:	5.51
IP(EA), eV:	-10.39(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-2-amino-5-[[5-(2-fluorophenyl)furan-2-yl]methylidene]-1,3-thiazol-4-one

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)NS(=O)(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations