Geometry & MOs

Info

ID:	155212
PubChem CID:	56322665
Reduced:	N3O7C20H23 (1)
Stoich.:	A3B7C20D23 (1)
Weight, g/mol:	481.167142
ΔH_f, kcal/mol:	-168.88
Dipole, Da:	5.36
IP(EA), eV:	-9.1(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(benzylsulfamoyl)-N-[3-[(3-hydroxybenzoyl)amino]propyl]-4-methylbenzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)C(=O)NCCCNC(=O)C2=CC(=CC=C2)O)[N+](=O)[O-])OC

DOS

IR

Vibrations