Geometry & MOs

Info

ID:	398193
PubChem CID:	135032256
Reduced:	NO3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	420.132136
ΔH_f, kcal/mol:	-126.7
Dipole, Da:	2.45
IP(EA), eV:	-8.87(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,6-bis(1,3-dioxoisoindol-2-yl)hexanoate

Drug info:

PubChemData

Smile

CC(=O)OC1CCN2C(=O)CCCC3=C2C1=CC=C3

DOS

IR

Vibrations