Geometry & MOs

Info

ID:	243281
PubChem CID:	99218169
Reduced:	ClFS2N3O3H17C20 (1)
Stoich.:	ABC2D3E3F17G20 (1)
Weight, g/mol:	406.055419
ΔH_f, kcal/mol:	-80.82
Dipole, Da:	3.18
IP(EA), eV:	-9.22(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-chloro-4-fluorophenyl)-1,3-thiazol-2-yl]-2-(2,4-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)F)Cl

DOS

IR

Vibrations