Geometry & MOs

Info

ID:	220380
PubChem CID:	85182289
Reduced:	O4C13H15 (2)
Stoich.:	A4B13C15 (2)
Weight, g/mol:	470.184172
ΔH_f, kcal/mol:	-257.15
Dipole, Da:	1.94
IP(EA), eV:	-8.48(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-(1-benzyl-2-methyl-3-oxamoylindol-4-yl)oxypropanoate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C=CC(=O)OCCCCOC(=O)C=CC2=CC(=C(C=C2)OC)OC)OC

DOS

IR

Vibrations