Geometry & MOs

Info

ID:	290772
PubChem CID:	110525995
Reduced:	O3N4H14C17 (1)
Stoich.:	A3B4C14D17 (1)
Weight, g/mol:	329.153955
ΔH_f, kcal/mol:	-21.59
Dipole, Da:	5.74
IP(EA), eV:	-8.26(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-fluoroanilino)-1-oxopropan-2-yl]-4-pyridin-3-ylbutanamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=O)N1)C(=O)NN/C=C/2\C(=O)C=CC3=CC=CC=C32

DOS

IR

Vibrations