Geometry & MOs

Info

ID:	87340
PubChem CID:	49894177
Reduced:	SI2N2O4H14C21 (1)
Stoich.:	AB2C2D4E14F21 (1)
Weight, g/mol:	483.029184
ΔH_f, kcal/mol:	4.76
Dipole, Da:	3.91
IP(EA), eV:	-8.99(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5Z)-5-[[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

C#CCOC1=C(C=C(C=C1I)/C=C\2/C(=O)N(C(=O)S2)CC(=O)NC3=CC=CC=C3)I

DOS

IR

Vibrations