Geometry & MOs

Info

ID:	333629
PubChem CID:	127252181
Reduced:	FN2O2H21C23 (1)
Stoich.:	AB2C2D21E23 (1)
Weight, g/mol:	396.104084
ΔH_f, kcal/mol:	-52.95
Dipole, Da:	1.95
IP(EA), eV:	-9.27(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[5-(3-chlorophenyl)pyridin-2-yl]morpholin-4-yl]-(4-fluorophenyl)methanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CC=C(C=C2)F)C3=CC=CC(=N3)CC4=CC=CC=C4

DOS

IR

Vibrations