Geometry & MOs

Info

ID:	333761
PubChem CID:	127252313
Reduced:	FN3O3H24C25 (1)
Stoich.:	AB3C3D24E25 (1)
Weight, g/mol:	433.18017
ΔH_f, kcal/mol:	-102.62
Dipole, Da:	7.86
IP(EA), eV:	-9.23(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-[4-[3-(4-fluorophenyl)propanoyl]morpholin-2-yl]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CCC2=CC=C(C=C2)F)C3=CC=CC(=N3)C4=CC=C(C=C4)C(=O)N

DOS

IR

Vibrations