Geometry & MOs

Info

ID:	243309
PubChem CID:	99218280
Reduced:	S2N3O5C19H19 (1)
Stoich.:	A2B3C5D19E19 (1)
Weight, g/mol:	477.076134
ΔH_f, kcal/mol:	-82.89
Dipole, Da:	6.39
IP(EA), eV:	-9.46(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(tert-butylsulfamoyl)phenyl]-5-(2-chloro-4-nitrophenyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)NS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

DOS

IR

Vibrations