Geometry & MOs

Info

ID:	87512
PubChem CID:	49895145
Reduced:	NSO3H23C26 (1)
Stoich.:	ABC3D23E26 (1)
Weight, g/mol:	389.108565
ΔH_f, kcal/mol:	-48.74
Dipole, Da:	4.8
IP(EA), eV:	-8.99(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(2-methoxynaphthalen-1-yl)methylidene]-3-[(2-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)COC2=CC=CC=C2/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC=C4C

DOS

IR

Vibrations