Geometry & MOs

Info

ID:	89379
PubChem CID:	49961276
Reduced:	SN4O6C22H24 (1)
Stoich.:	AB4C6D22E24 (1)
Weight, g/mol:	558.175933
ΔH_f, kcal/mol:	-166.88
Dipole, Da:	10.54
IP(EA), eV:	-9.3(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[[4-(diethylamino)phenyl]sulfamoyl]phenyl]carbamothioyl]-4-phenylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=NC(=N3)OC)OC)C

DOS

IR

Vibrations