Geometry & MOs

Info

ID:	332291
PubChem CID:	127250577
Reduced:	FO2N5H18C22 (1)
Stoich.:	AB2C5D18E22 (1)
Weight, g/mol:	394.144119
ΔH_f, kcal/mol:	8.47
Dipole, Da:	3.78
IP(EA), eV:	-9.07(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenoxy)-1-[2-(6-pyrimidin-5-ylpyridin-2-yl)morpholin-4-yl]ethanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CN3C=CC=NC3=N2)C4=CC=CC(=N4)C5=CC(=CC=C5)F

DOS

IR

Vibrations