Geometry & MOs

Info

ID:

168834

PubChem CID:

75024830

Reduced:

O13N15C66H89 (1)

Stoich.:

A13B15C66D89 (1)

Weight, g/mol:

387.150429

ΔHf, kcal/mol:

-482.45

Dipole, Da:

12.52

IP(EA), eV:

 -8.69(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[[4-(3,7-dimethylocta-2,6-dienoxy)-3-methoxyphenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCCNC(=O)CC1C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)NC(C(=O)N1)CCCN=C(N)N)CC3=CC=CC=C3)CC4=CC=CC=C4)CC5=CC=C(C=C5)O)CCCN)C(C)C)CC6=CC=C(C=C6)O

DOS

IR

Vibrations