Geometry & MOs

Info

ID:	28463
PubChem CID:	827748
Reduced:	N3O3C13H15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	317.068808
ΔH_f, kcal/mol:	-79.2
Dipole, Da:	2.9
IP(EA), eV:	-8.53(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-[naphthalen-1-yl(nitro)methylidene]-2-benzofuran-1-one

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C(=O)NN2C(=O)CCC2=O

DOS

IR

Vibrations