Geometry & MOs

Info

ID:

329411

PubChem CID:

126736426

Reduced:

NO7C45H85 (1)

Stoich.:

AB7C45D85 (1)

Weight, g/mol:

1094.525042

ΔHf, kcal/mol:

-434.39

Dipole, Da:

3.39

IP(EA), eV:

-9.77(-1.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-[4-[2-[4-[4-[1-[4-[[2-diphenylphosphoryl-4-[(4-ethenylphenyl)methoxy]phenoxy]methyl]phenyl]-2-methylpropan-2-yl]oxy-3,5-dimethylphenoxy]-3,5-dimethylphenyl]propan-2-yl]-2,6-dimethylphenoxy]-2,6-dimethylphenol

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCOCC(C(C)OC(=O)ON1C(=O)CCC1=O)OCCCCCCCCCCCCCCCCCC

DOS

IR

Vibrations