Geometry & MOs

Info

ID:	331852
PubChem CID:	127250138
Reduced:	ClN3O3C23H28 (1)
Stoich.:	AB3C3D23E28 (1)
Weight, g/mol:	423.175833
ΔH_f, kcal/mol:	-86.96
Dipole, Da:	2.25
IP(EA), eV:	-8.86(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluorophenyl)-2-[2-[5-[(2-fluorophenyl)methyl]pyridin-2-yl]morpholin-4-yl]acetamide

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CCN2CCOC(C2)C3=NC=C(C=C3)CC4=CC=CC=C4Cl

DOS

IR

Vibrations