Geometry & MOs

Info

ID:	149950
PubChem CID:	53789632
Reduced:	O5H10C12 (1)
Stoich.:	A5B10C12 (1)
Weight, g/mol:	267.98474
ΔH_f, kcal/mol:	-172.11
Dipole, Da:	5.41
IP(EA), eV:	-11.28(-2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-(ethylamino)isoindole-1,3-dione

Drug info:

PubChemData

Smile

CCCOC(=O)C1=CC2=C(C=C1)C(=O)OC2=O

DOS

IR

Vibrations