Geometry & MOs

Info

ID:	87627
PubChem CID:	49896016
Reduced:	BrNSO4H18C25 (1)
Stoich.:	ABCD4E18F25 (1)
Weight, g/mol:	483.04627
ΔH_f, kcal/mol:	-73.12
Dipole, Da:	2.56
IP(EA), eV:	-9.34(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]-3-[(3-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)OC(=O)C4=CC(=CC=C4)Br)/SC2=O

DOS

IR

Vibrations