Geometry & MOs

Info

ID:	87898
PubChem CID:	49898481
Reduced:	NSO5H21C25 (1)
Stoich.:	ABC5D21E25 (1)
Weight, g/mol:	431.119129
ΔH_f, kcal/mol:	-129.26
Dipole, Da:	3.66
IP(EA), eV:	-8.93(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-3-(naphthalen-2-ylmethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC4=CC=CC=C4C=C3)OC(=O)C

DOS

IR

Vibrations