Geometry & MOs

Info

ID:	87807
PubChem CID:	49897569
Reduced:	FSBr2N2O4H17C25 (1)
Stoich.:	ABC2D2E4F17G25 (1)
Weight, g/mol:	488.140593
ΔH_f, kcal/mol:	-102.75
Dipole, Da:	2.02
IP(EA), eV:	-9.03(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5Z)-5-[[3-methoxy-4-[(3-methylphenyl)methoxy]phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)CN2C(=O)/C(=C/C3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4F)Br)/SC2=O

DOS

IR

Vibrations