Geometry & MOs

Info

ID:

439414

PubChem CID:

135229188

Reduced:

SO2N3C14H23 (1)

Stoich.:

AB2C3D14E23 (1)

Weight, g/mol:

1220.471078

ΔHf, kcal/mol:

-71.37

Dipole, Da:

5.29

IP(EA), eV:

 -8.44(0.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[3-[[2-(2-methylprop-2-enoyloxy)-5-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]-[4-[(3E,5Z)-1-[2-(2-methylprop-2-enoyloxy)-5-[4-(2-methylprop-2-enoyloxy)phenyl]phenyl]-4-[4-(2-methylprop-2-enoyloxy)phenyl]octa-3,5-dien-7-ynyl]phenyl]methyl]cyclopenta-1,4-dien-1-yl]phenyl] 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CCSC1=C(N=C(N1C)C2CC2)NC(=O)OC(C)(C)C

DOS

IR

Vibrations