Geometry & MOs

Info

ID:	288747
PubChem CID:	104324887
Reduced:	NO2C15H17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	267.069557
ΔH_f, kcal/mol:	-17.6
Dipole, Da:	7.17
IP(EA), eV:	-9.06(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-fluorophenyl)methoxy]-1-benzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

CC(C)CCCOC1=C(OC2=CC=CC=C21)C#N

DOS

IR

Vibrations