Geometry & MOs

Info

ID:	87547
PubChem CID:	49895301
Reduced:	NSCl2O3H15C19 (1)
Stoich.:	ABC2D3E15F19 (1)
Weight, g/mol:	430.03506
ΔH_f, kcal/mol:	-79.08
Dipole, Da:	2.61
IP(EA), eV:	-9.28(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-3-[(2-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C(=O)/C(=C/C3=CC(=C(C(=C3)Cl)OC)Cl)/SC2=O

DOS

IR

Vibrations