Geometry & MOs

Info

ID:	54225
PubChem CID:	16955336
Reduced:	S2F3O4N6H15C21 (1)
Stoich.:	A2B3C4D6E15F21 (1)
Weight, g/mol:	541.016002
ΔH_f, kcal/mol:	-187.56
Dipole, Da:	10.8
IP(EA), eV:	-9.35(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]-2-[4-(trifluoromethoxy)anilino]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CSC(=N3)NC4=CC=C(C=C4)OC(F)(F)F

DOS

IR

Vibrations