Geometry & MOs

Info

ID:	234605
PubChem CID:	92303155
Reduced:	O3N4C24H26 (1)
Stoich.:	A3B4C24D26 (1)
Weight, g/mol:	414.088557
ΔH_f, kcal/mol:	-8.92
Dipole, Da:	6.27
IP(EA), eV:	-8.96(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5Z)-5-[(3,4-dihydroxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-ethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)[C@H]2C(=C(N=C3N2NC=N3)C)C(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations