Geometry & MOs

Info

ID:	333760
PubChem CID:	127252312
Reduced:	FO2N4H21C22 (1)
Stoich.:	AB2C4D21E22 (1)
Weight, g/mol:	433.18017
ΔH_f, kcal/mol:	-36.43
Dipole, Da:	3.68
IP(EA), eV:	-9.39(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[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=NC=C(C=C3)C4=CN=CN=C4

DOS

IR

Vibrations