Geometry & MOs

Info

ID:	23456
PubChem CID:	603801
Reduced:	NO2H8C10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	348.111007
ΔH_f, kcal/mol:	-40.8
Dipole, Da:	6.38
IP(EA), eV:	-8.46(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethylideneamino)-3-methoxynaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC2=CC=CC=C2C=C1C(=O)NN=CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations