Geometry & MOs

Info

ID:	332720
PubChem CID:	127251030
Reduced:	FO2N5H20C21 (1)
Stoich.:	AB2C5D20E21 (1)
Weight, g/mol:	394.144119
ΔH_f, kcal/mol:	-22.17
Dipole, Da:	1.83
IP(EA), eV:	-9.0(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-[6-(3-fluorophenyl)pyrazin-2-yl]morpholine-4-carbonyl]-1-methylpyridin-2-one

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C(=O)N2CCOC(C2)C3=NC(=CN=C3)C4=CC=CC=C4F

DOS

IR

Vibrations