Geometry & MOs

Info

ID:	175371
PubChem CID:	75890963
Reduced:	NO2H15C18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	251.074642
ΔH_f, kcal/mol:	14.01
Dipole, Da:	3.36
IP(EA), eV:	-8.98(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(2-fluorophenyl)prop-2-enoyl]benzonitrile

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C=CC(=O)C2=CC=CC(=C2)C#N

DOS

IR

Vibrations