Geometry & MOs

Info

ID:

411966

PubChem CID:

135084822

Reduced:

N2O3C27H28 (1)

Stoich.:

A2B3C27D28 (1)

Weight, g/mol:

976.26284

ΔHf, kcal/mol:

-36.38

Dipole, Da:

3.34

IP(EA), eV:

 -8.96(-0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 -1

Chem-info

IUPAC name:

[1-[2-bis(4-methylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(4-methylphenyl)phosphane;(1Z,5Z)-cycloocta-1,5-diene;rhodium;tetrafluoroborate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=CC=C2N=C1)[C@@H](C3CC4CCN3CC4C=C)OC(=O)C5=CC=CC=C5

DOS

IR

Vibrations