Geometry & MOs

Info

ID:

181417

PubChem CID:

76745576

Reduced:

O2C35H60 (1)

Stoich.:

A2B35C60 (1)

Weight, g/mol:

1386.648668

ΔHf, kcal/mol:

-140.32

Dipole, Da:

4.86

IP(EA), eV:

 -9.4(0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[8-hydroxy-3,6-bis[(11-methyl-4,10-dioxododec-11-en-3-yl)sulfamoyl]pyren-1-yl]sulfonylamino]-10-methyl-3,9-dioxoundec-10-ene-1-sulfonate;tetrabutylazanium

Drug info:

PubChemData

Smile

CCC=CCC=CCC=CCC=CCC=CCCCCCCCCCCCCCCCCCCC(=O)O

DOS

IR

Vibrations