Geometry & MOs

Info

ID:

340762

PubChem CID:

127262774

Reduced:

PO2C41H45 (1)

Stoich.:

AB2C41D45 (1)

Weight, g/mol:

1014.563356

ΔHf, kcal/mol:

-62.45

Dipole, Da:

2.97

IP(EA), eV:

 -8.24(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-[2-(diphenylphosphanylmethyl)-6-methoxy-3-[2,4,6-tri(propan-2-yl)phenyl]phenyl]-3-methoxy-6-[2,4,6-tri(propan-2-yl)phenyl]phenyl]methyl-diphenylphosphane

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)OC2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C54)P(=O)(C6CCCCC6)C7CCCCC7)C

DOS

IR

Vibrations