Geometry & MOs

Info

ID:	80958
PubChem CID:	49854120
Reduced:	N2O2C9H9 (2)
Stoich.:	A2B2C9D9 (2)
Weight, g/mol:	356.148455
ΔH_f, kcal/mol:	-86.65
Dipole, Da:	5.87
IP(EA), eV:	-9.18(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COCCN1C2=CC(=O)N=C(N2)CC(=O)NC3=C4C=COC4=CC=C3

DOS

IR

Vibrations