Geometry & MOs

Info

ID:	87511
PubChem CID:	49895135
Reduced:	BrFNSO3H19C25 (1)
Stoich.:	ABCDE3F19G25 (1)
Weight, g/mol:	429.139865
ΔH_f, kcal/mol:	-82.42
Dipole, Da:	4.83
IP(EA), eV:	-9.21(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(=O)/C(=C/C3=CC(=C(C=C3)OCC4=CC=C(C=C4)F)Br)/SC2=O

DOS

IR

Vibrations