Geometry & MOs

Info

ID:	67730
PubChem CID:	46507052
Reduced:	S2O3N4C26H32 (1)
Stoich.:	A2B3C4D26E32 (1)
Weight, g/mol:	490.138485
ΔH_f, kcal/mol:	-78.0
Dipole, Da:	3.17
IP(EA), eV:	-8.48(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethylphenyl)-3-[methyl-(4-methylphenyl)sulfamoyl]-4-phenylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3(CCN(CC3)C(=O)OC(C)(C)C)N=C2C4=CC=CS4)C

DOS

IR

Vibrations