Geometry & MOs

Info

ID:

329470

PubChem CID:

126737181

Reduced:

NO4C9H15 (1)

Stoich.:

AB4C9D15 (1)

Weight, g/mol:

1653.797164

ΔHf, kcal/mol:

-189.99

Dipole, Da:

7.15

IP(EA), eV:

-10.36(0.23)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-diphenylphosphanyl-4-[[4-[4-[2-[4-[2-[4-[2-[4-[2-[4-[1-[4-[4-[(3-diphenylphosphoryl-4-hydroxyphenoxy)methyl]phenyl]phenyl]-2-methylpropan-2-yl]oxy-3,5-dimethylphenyl]propan-2-yloxy]-3,5-dimethylphenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-yl]-2,6-dimethylphenoxy]-2-methylpropyl]phenyl]phenyl]methoxy]phenol

Drug info:

PubChemData

Smile

C1CC(NC1)C(=O)OCCCC(=O)O

DOS

IR

Vibrations