Geometry & MOs

Info

ID:	81166
PubChem CID:	49854423
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	354.169191
ΔH_f, kcal/mol:	-92.25
Dipole, Da:	3.15
IP(EA), eV:	-8.36(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)N1CC2CC2(C1)C3=CC=C(C=C3)N4CCOCC4

DOS

IR

Vibrations