Geometry & MOs

Info

ID:	300625
PubChem CID:	123046085
Reduced:	NO5C32H35 (1)
Stoich.:	AB5C32D35 (1)
Weight, g/mol:	509.0474
ΔH_f, kcal/mol:	-141.68
Dipole, Da:	8.71
IP(EA), eV:	-8.72(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-1-(4-bromophenyl)-4-[(2,5-dimethoxyphenyl)-hydroxymethylidene]-5-(3-hydroxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=C(C=CC(=C3)C)C)C4=CC(=CC=C4)OCC(C)C)/O

DOS

IR

Vibrations