Geometry & MOs

Info

ID:	86871
PubChem CID:	49889860
Reduced:	FNSCl2O3H18C25 (1)
Stoich.:	ABCD2E3F18G25 (1)
Weight, g/mol:	480.970912
ΔH_f, kcal/mol:	-101.27
Dipole, Da:	4.82
IP(EA), eV:	-9.42(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-[(2,4-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)COC2=C(C=C(C=C2Cl)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)F)Cl

DOS

IR

Vibrations