Geometry & MOs

Info

ID:	139783
PubChem CID:	52594869
Reduced:	SN4O4C22H30 (1)
Stoich.:	AB4C4D22E30 (1)
Weight, g/mol:	435.182792
ΔH_f, kcal/mol:	-121.77
Dipole, Da:	6.12
IP(EA), eV:	-9.11(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-(2-methoxyethoxy)phenyl]methyl]-3-[4-[methyl(propan-2-yl)sulfamoyl]phenyl]urea

Drug info:

PubChemData

Smile

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC=C3OC

DOS

IR

Vibrations