Geometry & MOs

Info

ID:	42976
PubChem CID:	10317488
Reduced:	N2O5H18C21 (1)
Stoich.:	A2B5C18D21 (1)
Weight, g/mol:	378.121572
ΔH_f, kcal/mol:	-141.88
Dipole, Da:	3.85
IP(EA), eV:	-8.76(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-[(1,3-dioxoisoindol-2-yl)methyl]-2,3-dihydroindol-1-yl]-2-oxoacetate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CC(=C(C=C3)O)O)O

DOS

IR

Vibrations