Geometry & MOs

Info

ID:	88329
PubChem CID:	49902953
Reduced:	SN2O2H24C26 (1)
Stoich.:	AB2C2D24E26 (1)
Weight, g/mol:	481.134779
ΔH_f, kcal/mol:	-16.04
Dipole, Da:	7.71
IP(EA), eV:	-8.26(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-(naphthalen-1-ylmethyl)-5-[[3-(2-phenoxyethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N2CCCC2)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC5=CC=CC=C54

DOS

IR

Vibrations