Geometry & MOs

Info

ID:	43490
PubChem CID:	10321383
Reduced:	SO4N5H17C22 (1)
Stoich.:	AB4C5D17E22 (1)
Weight, g/mol:	446.988056
ΔH_f, kcal/mol:	23.52
Dipole, Da:	5.93
IP(EA), eV:	-8.93(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(benzenesulfonyl)-N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC(=O)C1=NN(C2=C(C1=O)C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)N=NC4=CC=CC=C4

DOS

IR

Vibrations