Geometry & MOs

Info

ID:

51822

PubChem CID:

12014573

Reduced:

N2O3H14C16 (2)

Stoich.:

A2B3C14D16 (2)

Weight, g/mol:

460.146952

ΔHf, kcal/mol:

-74.41

Dipole, Da:

4.68

IP(EA), eV:

 -8.64(-0.61)

Spin(Sz, S2):

 None, None

Charge, e:

 2

Chem-info

IUPAC name:

4,6,10,12-tetramethyl-5,11-bis(4-methylphenyl)-5,11-diaza-2,8-diphosphoniatricyclo[7.3.0.03,7]dodeca-1(12),3,6,9-tetraene 2,8-dioxide

Drug info:

PubChemData

Smile

C[C@]12C[C@@]3(C4=C(C=CC=C4OC)OC(=O)N3NC5=CC=CC=C5)N(N1C(=O)OC6=C2C(=CC=C6)OC)C7=CC=CC=C7

DOS

IR

Vibrations