Geometry & MOs

Info

ID:	288724
PubChem CID:	104324368
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	250.074228
ΔH_f, kcal/mol:	-0.07
Dipole, Da:	5.07
IP(EA), eV:	-8.82(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-aminophenoxy)-1-benzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(O2)CN)OCCC3=CC=NC=C3

DOS

IR

Vibrations