Geometry & MOs

Info

ID:	83716
PubChem CID:	49860528
Reduced:	ClN2C19H41 (1)
Stoich.:	AB2C19D41 (1)
Weight, g/mol:	514.144154
ΔH_f, kcal/mol:	-97.61
Dipole, Da:	3.05
IP(EA), eV:	-8.54(1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(3-nitroacridin-9-yl)amino]phenyl]hexane-1-sulfonamide;hydrochloride

Drug info:

PubChemData

Smile

CCCCCC1(CCN(C1)CCCN(C)C)CCCCC.Cl

DOS

IR

Vibrations