Geometry & MOs

Info

ID:	81075
PubChem CID:	49854318
Reduced:	FON2C15H19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	441.237604
ΔH_f, kcal/mol:	-39.2
Dipole, Da:	1.86
IP(EA), eV:	-8.87(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-morpholin-4-yl-4-oxo-1H-pyrimidin-2-yl)-N-[2-(2-piperidin-1-ylethoxy)phenyl]acetamide

Drug info:

PubChemData

Smile

C1COCCN1C2=C(C=C(C=C2)C34CC3CNC4)F

DOS

IR

Vibrations