Geometry & MOs

Info

ID:	87206
PubChem CID:	49893065
Reduced:	BrClSN2O2H22C25 (1)
Stoich.:	ABCD2E2F22G25 (1)
Weight, g/mol:	437.025535
ΔH_f, kcal/mol:	-34.07
Dipole, Da:	6.65
IP(EA), eV:	-8.53(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)N2C(=CC(=C2C)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC=C4Cl)C

DOS

IR

Vibrations