Geometry & MOs

Info

ID:

432925

PubChem CID:

135173062

Reduced:

OPN2H41C52 (1)

Stoich.:

ABC2D41E52 (1)

Weight, g/mol:

706.253786

ΔHf, kcal/mol:

160.83

Dipole, Da:

4.76

IP(EA), eV:

 -8.9(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-(4-naphthalen-1-yl-9,9-diphenylindeno[2,1-d]pyrimidin-2-yl)phenyl]-diphenylphosphane

Drug info:

PubChemData

Smile

C1CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=C(C=C3)C4=NC(=C5C6=CC=CC=C6CC7(CC=CC=C7)C(C5=N4)C8=CC=CC=C8)C9=CC=CC1=CC=CC=C19

DOS

IR

Vibrations