Geometry & MOs

Info

ID:

176614

PubChem CID:

76074155

Reduced:

FN3O6C31H32 (1)

Stoich.:

AB3C6D31E32 (1)

Weight, g/mol:

576.402604

ΔHf, kcal/mol:

-232.81

Dipole, Da:

6.37

IP(EA), eV:

 -8.97(-1.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[3-[[2-(5-cyclopentyl-4-methylpentyl)-5-methylidenecyclopentyl]methyl]oxiran-2-yl]-2,2-bis(oxan-2-yloxy)butanoic acid

Drug info:

PubChemData

Smile

C1CCN(C1)C2=C(C(=C(C=C2)O)C(=O)C3=CC=C(C=C3)C(=O)OC4CCCNCC4NC(=O)C5=CC=C(C=C5)O)F

DOS

IR

Vibrations