Geometry & MOs

Info

ID:	88188
PubChem CID:	49902222
Reduced:	NSBr3O3H14C20 (1)
Stoich.:	ABC3D3E14F20 (1)
Weight, g/mol:	670.87581
ΔH_f, kcal/mol:	-26.68
Dipole, Da:	3.69
IP(EA), eV:	-9.69(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-bromo-4-[(3,4-dichlorophenyl)methoxy]-5-ethoxyphenyl]methylidene]-3-[(4-bromophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C=CCOC1=C(C=C(C=C1Br)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)Br)Br

DOS

IR

Vibrations