Geometry & MOs

Info

ID:

44882

PubChem CID:

10506341

Reduced:

O2C11H12 (3)

Stoich.:

A2B11C12 (3)

Weight, g/mol:

528.175264

ΔHf, kcal/mol:

-145.67

Dipole, Da:

5.08

IP(EA), eV:

 -8.79(0.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[(4-hydroxycyclopent-2-en-1-yl)-(4-methylphenyl)sulfonylamino]cyclopent-2-en-1-yl]-4-methyl-N-prop-2-enylbenzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CO[C@@H](COCC2=CC=CC=C2)[C@@H](COCC3=CC=CC=C3)OC4=CC=CC=C4OC

DOS

IR

Vibrations