Geometry & MOs

Info

ID:	88339
PubChem CID:	49902983
Reduced:	SN2O2H22C25 (1)
Stoich.:	AB2C2D22E25 (1)
Weight, g/mol:	465.114713
ΔH_f, kcal/mol:	11.9
Dipole, Da:	7.59
IP(EA), eV:	-8.28(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-(naphthalen-1-ylmethyl)-5-[[(3E)-6-oxo-3-(phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)/C=C/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations