Geometry & MOs

Info

ID:

383239

PubChem CID:

134974859

Reduced:

LiPO4C6H8 (2)

Stoich.:

ABC4D6E8 (2)

Weight, g/mol:

439.235873

ΔHf, kcal/mol:

-532.66

Dipole, Da:

1.5

IP(EA), eV:

 -9.2(-0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z,4Z)-N-[(E)-3-[(1S,11S,13R,15R)-15-hydroxy-7-methyl-9-oxo-10,17-dioxatricyclo[11.3.1.03,8]heptadeca-3,5,7-trien-11-yl]prop-1-enyl]hepta-2,4-dienamide

Drug info:

PubChemData

Smile

[Li+].[Li+].COC(=O)C1=CC(=CC(=C1)CP(=O)([O-])OC)CP(=O)([O-])OC

DOS

IR

Vibrations