Geometry & MOs

Info

ID:	81553
PubChem CID:	49854857
Reduced:	F2O3N4C18H18 (1)
Stoich.:	A2B3C4D18E18 (1)
Weight, g/mol:	369.18009
ΔH_f, kcal/mol:	-158.01
Dipole, Da:	5.18
IP(EA), eV:	-9.3(-0.92)
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-(1,2,3,4-tetrahydroquinolin-8-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(C2=CC(=C(C=C21)F)F)C(=O)CC3=NC(=O)C=C(N3)N4CCOCC4

DOS

IR

Vibrations