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Merck
CN

922897

Sigma-Aldrich

[Ir(ppy)2(5,5′-Me2bpy)]PF6

≥95%, powder

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About This Item

Empirical Formula (Hill Notation):
C34H28F6IrN4P
CAS Number:
808142-82-7
Molecular Weight:
829.79
MDL number:
MFCD34602233
UNSPSC Code:
12352101
NACRES:
NA.22

Key Documents

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Product Name

[Ir(ppy)2(5,5′-Me2bpy)]PF6, ≥95%

Quality Level

100

Assay

≥95%

form

powder

reaction suitability

reaction type: Photocatalysis
reagent type: catalyst

SMILES string

[Ir+]741([NH]8=C(c9c7cccc9)C=CC=C8)([NH]5=CC=CC=C5c6c4cccc6)[NH]2=CC(=CC=C2C3=CC=C(C=[NH]31)C)C.F[P-](F)(F)(F)(F)F

InChI

1S/C12H12N2.2C11H8N.F6P.Ir/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-7(2,3,4,5)6;/h3-8H,1-2H3;2*1-6,8-9H;;/q;;;-1;+1

InChI key

JFNHYYZGRBJZIH-UHFFFAOYSA-N

Application

[Ir(ppy)2(5,5′-Me2bpy)]PF6 is a photoredox catalyst used for a variety of transformations.

Product can be used with our line of photoreactors: Including Penn PhD (Z744035) & SynLED 2.0 (Z744080)

Other Notes

Mechanistic Analysis of Metallaphotoredox C-N Coupling: Photocatalysis Initiates and Perpetuates Ni(I)/Ni(III) Coupling Activity

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Information

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Nicholas A Till et al.
Journal of the American Chemical Society, 142(37), 15830-15841 (2020-08-14)
The combined use of reaction kinetic analysis, ultrafast spectroscopy, and stoichiometric organometallic studies has enabled the elucidation of the mechanistic underpinnings to a photocatalytic C-N cross-coupling reaction. Steady-state and ultrafast spectroscopic techniques were used to track the excited-state evolution of

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