Geometry & MOs

Info

ID:	229307
PubChem CID:	87567382
Reduced:	O7C8H18 (1)
Stoich.:	A7B8C18 (1)
Weight, g/mol:	401.16608
ΔH_f, kcal/mol:	-328.63
Dipole, Da:	1.74
IP(EA), eV:	-10.25(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-[[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-(methoxymethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C(C(COCC(O)OCC(CO)O)O)O

DOS

IR

Vibrations