Geometry & MOs

Info

ID:	338617
PubChem CID:	127259628
Reduced:	N2O2C7H7 (2)
Stoich.:	A2B2C7D7 (2)
Weight, g/mol:	393.220498
ΔH_f, kcal/mol:	20.78
Dipole, Da:	9.37
IP(EA), eV:	-9.07(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[(E)-benzylideneamino]-1-N,1-N-diethyl-4-N-naphthalen-1-ylbenzene-1,4-diamine

Drug info:

PubChemData

Smile

COC1=C(C(=NC=C1[N+](=O)[O-])N/N=C/C2=CC=CC=C2)OC

DOS

IR

Vibrations