Geometry & MOs

Info

ID:

411972

PubChem CID:

135084828

Reduced:

BRhP2F4O4H38C46 (1)

Stoich.:

ABC2D4E4F38G46 (1)

Weight, g/mol:

1028.29414

ΔHf, kcal/mol:

-298.71

Dipole, Da:

21.64

IP(EA), eV:

 -9.1(-3.01)

Spin(Sz, S2):

 None, None

Charge, e:

 -1

Chem-info

IUPAC name:

(1Z,5Z)-cycloocta-1,5-diene;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;rhodium;tetrafluoroborate

Drug info:

PubChemData

Smile

[B-](F)(F)(F)F.C1/C=C\CC/C=C\C1.C1OC2=C(O1)C=CC(=C2C3=C(C=CC4=C3OCO4)P(C5=CC=CC=C5)C6=CC=CC=C6)P(C7=CC=CC=C7)C8=CC=CC=C8.[Rh]

DOS

IR

Vibrations