Geometry & MOs

Info

ID:	87656
PubChem CID:	49896314
Reduced:	NSO6H21C22 (1)
Stoich.:	ABC6D21E22 (1)
Weight, g/mol:	463.125358
ΔH_f, kcal/mol:	-191.35
Dipole, Da:	3.81
IP(EA), eV:	-9.22(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylidene]-3-[(3-methylphenyl)methyl]-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=CC=CC(=C3)C)OCC(=O)O

DOS

IR

Vibrations