Geometry & MOs

Info

ID:

448119

PubChem CID:

135288614

Reduced:

FO2N8H21C27 (1)

Stoich.:

AB2C8D21E27 (1)

Weight, g/mol:

856.542409

ΔHf, kcal/mol:

77.07

Dipole, Da:

8.34

IP(EA), eV:

 -8.88(-2.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[(E)-hexadec-1-enyl]-1-[4-[4-[3-[(E)-hexadec-1-enyl]-2,5-dioxopyrrolidin-1-yl]phenyl]sulfonylphenyl]pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=CN=CC(=C1)C2=NC\3=C(C=C2)NN/C3=C\4/N=C5C=CN=C(C5=N4)C6=CC(=CC(=C6)F)O

DOS

IR

Vibrations