Geometry & MOs

Info

ID:	81171
PubChem CID:	49854428
Reduced:	NOC5H6 (4)
Stoich.:	ABC5D6 (4)
Weight, g/mol:	383.159354
ΔH_f, kcal/mol:	-113.97
Dipole, Da:	9.44
IP(EA), eV:	-9.13(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6-morpholin-4-yl-4-oxo-1H-pyrimidin-2-yl)acetyl]-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC2=C1CCN2C(=O)CC3=NC(=O)C=C(N3)N4CCOCC4

DOS

IR

Vibrations