Geometry & MOs

Info

ID:	81266
PubChem CID:	49854526
Reduced:	FO3N4C19H21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	354.169191
ΔH_f, kcal/mol:	-129.03
Dipole, Da:	6.16
IP(EA), eV:	-9.12(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C(=O)C=C(N=C1CC(=O)N2CCC3=C2C=C(C=C3)F)N4CCOCC4

DOS

IR

Vibrations