Geometry & MOs

Info

ID:	84244
PubChem CID:	49865096
Reduced:	ON6C21H24 (1)
Stoich.:	AB6C21D24 (1)
Weight, g/mol:	470.126006
ΔH_f, kcal/mol:	72.86
Dipole, Da:	8.1
IP(EA), eV:	-8.79(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[bis(2-phenylethyl)amino]-3,5-dinitrobenzenesulfonamide

Drug info:

PubChemData

Smile

C1C[C@H](NC1)CNC(=O)C2=CC=C(C=C2)C3=CN=C4N3N=C(C=C4)NC5CC5

DOS

IR

Vibrations