Geometry & MOs

Info

ID:	81076
PubChem CID:	49854321
Reduced:	O4N5C23H31 (1)
Stoich.:	A4B5C23D31 (1)
Weight, g/mol:	388.17467
ΔH_f, kcal/mol:	-120.55
Dipole, Da:	6.67
IP(EA), eV:	-8.94(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(CC1)CCOC2=CC=CC=C2NC(=O)CC3=NC(=O)C=C(N3)N4CCOCC4

DOS

IR

Vibrations