Geometry & MOs

Info

ID:	397606
PubChem CID:	135030461
Reduced:	BrO2H11C17 (2)
Stoich.:	AB2C11D17 (2)
Weight, g/mol:	325.131408
ΔH_f, kcal/mol:	-0.87
Dipole, Da:	8.36
IP(EA), eV:	-9.51(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-dioxoisoindol-2-yl) tricyclo[4.3.1.03,8]decane-8-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(C(C2C3=C(C(=O)C4=CC=CC=C4O3)Br)C5=C(C(=O)C6=CC=CC=C6O5)Br)C7=CC=CC=C7

DOS

IR

Vibrations