Geometry & MOs

Info

ID:	266509
PubChem CID:	103567991
Reduced:	NO3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	285.080121
ΔH_f, kcal/mol:	-34.85
Dipole, Da:	1.07
IP(EA), eV:	-9.41(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-fluorophenyl)-2-oxoethoxy]-5-methoxybenzonitrile

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C#N)OCC(=O)CC2=CC=CC=C2

DOS

IR

Vibrations