Geometry & MOs

Info

ID:	81792
PubChem CID:	49855164
Reduced:	ON2C28H32 (1)
Stoich.:	AB2C28D32 (1)
Weight, g/mol:	314.13789
ΔH_f, kcal/mol:	35.98
Dipole, Da:	5.17
IP(EA), eV:	-8.03(-0.06)
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-phenylacetamide

Drug info:

PubChemData

Smile

CCN1CC2C(C2(C1)C3=CC=C(C=C3)N4CCCC4)COC5=CC=CC6=CC=CC=C65

DOS

IR

Vibrations