Geometry & MOs

Info

ID:	171236
PubChem CID:	75347350
Reduced:	ClSN2O5C29H29 (1)
Stoich.:	ABC2D5E29F29 (1)
Weight, g/mol:	511.145344
ΔH_f, kcal/mol:	-161.08
Dipole, Da:	4.8
IP(EA), eV:	-8.55(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OCCN2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC(=C(C=C4)Cl)C(=O)O)C)SC2=O

DOS

IR

Vibrations