Geometry & MOs

Info

ID:	87549
PubChem CID:	49895304
Reduced:	ClNSO4H16C19 (1)
Stoich.:	ABCD4E16F19 (1)
Weight, g/mol:	417.080157
ΔH_f, kcal/mol:	-113.6
Dipole, Da:	2.49
IP(EA), eV:	-9.02(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-chloro-5-ethoxy-4-methoxyphenyl)methylidene]-3-[(3-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(=O)/C(=C/C3=C(C(=CC(=C3)Cl)OC)O)/SC2=O

DOS

IR

Vibrations