Geometry & MOs

Info

ID:	433259
PubChem CID:	135173396
Reduced:	O2S2N4H28C29 (1)
Stoich.:	A2B2C4D28E29 (1)
Weight, g/mol:	484.141656
ΔH_f, kcal/mol:	37.54
Dipole, Da:	3.56
IP(EA), eV:	-8.32(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[3-[[4-(dimethylamino)phenyl]carbamoylamino]phenyl]sulfamoyl]-4-methoxybenzoic acid

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC=CC(=C1)C2=CC(=C(C=C2)OC)SNC3=CC=CC(=C3)NC(=S)NC4=CC=CC=C4

DOS

IR

Vibrations