Geometry & MOs

Info

ID:	3250
PubChem CID:	9394
Reduced:	ON2C17H25 (2)
Stoich.:	AB2C17D25 (2)
Weight, g/mol:	546.393377
ΔH_f, kcal/mol:	9.02
Dipole, Da:	14.66
IP(EA), eV:	-6.22(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

benzyl-[3-[[4-[3-[benzyl(diethyl)azaniumyl]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propyl]-diethylazanium

Drug info:

PubChemData

Smile

CC[N+](CC)(CCCNC1=CC(=O)C(=CC1=O)NCCC[N+](CC)(CC)CC2=CC=CC=C2)CC3=CC=CC=C3

DOS

IR

Vibrations