Geometry & MOs

Info

ID:	35970
PubChem CID:	7980581
Reduced:	FN2O3C20H21 (1)
Stoich.:	AB2C3D20E21 (1)
Weight, g/mol:	285.116507
ΔH_f, kcal/mol:	-139.67
Dipole, Da:	4.68
IP(EA), eV:	-8.55(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluoro-2-methylphenyl)-4-oxo-4-phenylbutanamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=C(C=C(C=C3)F)C

DOS

IR

Vibrations