Geometry & MOs

Info

ID:	339141
PubChem CID:	127260520
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	259.059306
ΔH_f, kcal/mol:	-76.06
Dipole, Da:	1.33
IP(EA), eV:	-9.07(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-(3-nitrofuran-2-yl)methylideneamino]benzamide

Drug info:

PubChemData

Smile

CC1CNCCC1OC(=O)C2=CC=CC=C2

DOS

IR

Vibrations