Geometry & MOs

Info

ID:	51281
PubChem CID:	12013926
Reduced:	ClNO4C14H14 (1)
Stoich.:	ABC4D14E14 (1)
Weight, g/mol:	339.01062
ΔH_f, kcal/mol:	-127.41
Dipole, Da:	2.34
IP(EA), eV:	-8.82(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-1-[(2,4-dimethoxyphenyl)methyl]-4-methylpyrrole-2,5-dione

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(C1=O)CC2=C(C=C(C=C2)OC)OC)Cl

DOS

IR

Vibrations