Geometry & MOs

Info

ID:	301208
PubChem CID:	123069177
Reduced:	N2O5H30C33 (1)
Stoich.:	A2B5C30D33 (1)
Weight, g/mol:	521.08379
ΔH_f, kcal/mol:	-82.55
Dipole, Da:	4.83
IP(EA), eV:	-8.21(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-1-(4-bromophenyl)-5-(3-ethoxyphenyl)-4-[hydroxy-(2-methoxy-5-methylphenyl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C2/C(=C(/C3=C(C=CC(=C3)C)OC)\O)/C(=O)C(=O)N2C4=CC=C(C=C4)NC5=CC=CC=C5

DOS

IR

Vibrations