Geometry & MOs

Info

ID:	397894
PubChem CID:	135030922
Reduced:	NO6C20H25 (1)
Stoich.:	AB6C20D25 (1)
Weight, g/mol:	463.184232
ΔH_f, kcal/mol:	-246.05
Dipole, Da:	4.29
IP(EA), eV:	-8.34(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-[4-(1,3-diethoxy-1,3-dioxopropan-2-yl)-5-methoxy-1H-indol-2-yl]propanedioate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=CN(C2=CC=CC=C21)CCCC(=O)OC)C(=O)OCC

DOS

IR

Vibrations