Geometry & MOs

Info

ID:	81168
PubChem CID:	49854425
Reduced:	O3N4C19H22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	-78.12
Dipole, Da:	7.7
IP(EA), eV:	-9.16(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-[2-(3-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-6-morpholin-4-ylpyrimidin-4-one

Drug info:

PubChemData

Smile

C[C@@H]1CC2=CC=CC=C2N1C(=O)CC3=NC(=O)C=C(N3)N4CCOCC4

DOS

IR

Vibrations