Geometry & MOs

Info

ID:

49759

PubChem CID:

11533735

Reduced:

NSO5C30H35 (1)

Stoich.:

ABC5D30E35 (1)

Weight, g/mol:

521.223594

ΔHf, kcal/mol:

-161.92

Dipole, Da:

7.98

IP(EA), eV:

 -9.36(-0.85)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z)-5-[[3-methyl-4-[[2,5,7,8-tetramethyl-6-(3-methylbut-2-enoxy)-3,4-dihydrochromen-2-yl]methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCCCC(CC)(CS(=O)(=O)C1=C(C=C(C=C1)NC(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3)C=O

DOS

IR

Vibrations