Geometry & MOs

Info

ID:	332006
PubChem CID:	127250292
Reduced:	ClFN2O2H20C23 (1)
Stoich.:	ABC2D2E20F23 (1)
Weight, g/mol:	419.16452
ΔH_f, kcal/mol:	-63.8
Dipole, Da:	1.34
IP(EA), eV:	-9.3(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CC2=CC=C(C=C2)F)C3=NC=C(C=C3)C4=CC(=CC=C4)Cl

DOS

IR

Vibrations