Geometry & MOs

Info

ID:	446887
PubChem CID:	135278457
Reduced:	BrOC10H11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	399.190654
ΔH_f, kcal/mol:	-12.84
Dipole, Da:	3.2
IP(EA), eV:	-8.89(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dioxopiperidin-3-yl)-5-(3-piperazin-1-ylpropylamino)isoindole-1,3-dione

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)C(=C)Br

DOS

IR

Vibrations