Geometry & MOs

Info

ID:	274343
PubChem CID:	103808663
Reduced:	ClFON2C13H16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	273.12774
ΔH_f, kcal/mol:	-87.41
Dipole, Da:	4.03
IP(EA), eV:	-9.54(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(6-fluoropyridin-3-yl)-4-phenylbutanamide

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)C(=O)NCC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations