Geometry & MOs

Info

ID:	87818
PubChem CID:	49897738
Reduced:	SN2O6H16C23 (1)
Stoich.:	AB2C6D16E23 (1)
Weight, g/mol:	434.151158
ΔH_f, kcal/mol:	-128.82
Dipole, Da:	2.25
IP(EA), eV:	-8.99(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(4-butoxy-3-methoxyphenyl)methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)CN2C(=O)/C(=C/C3=CC=C(C=C3)OC(=O)C4=CC=CO4)/SC2=O

DOS

IR

Vibrations