Geometry & MOs

Info

ID:	300810
PubChem CID:	123055096
Reduced:	BrNO5H24C27 (1)
Stoich.:	ABC5D24E27 (1)
Weight, g/mol:	535.09944
ΔH_f, kcal/mol:	-113.9
Dipole, Da:	8.2
IP(EA), eV:	-8.62(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC(=CC=C3)OC)C4=CC=C(C=C4)Br)/O

DOS

IR

Vibrations