Geometry & MOs

Info

ID:	301163
PubChem CID:	123067403
Reduced:	ClNO5H22C29 (1)
Stoich.:	ABC5D22E29 (1)
Weight, g/mol:	541.188923
ΔH_f, kcal/mol:	-95.53
Dipole, Da:	11.33
IP(EA), eV:	-8.74(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-5-naphthalen-1-yl-1-(4-phenoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=C(C=CC(=C3)Cl)O)C4=CC=CC5=CC=CC=C54)/O

DOS

IR

Vibrations