Iridium Complex Blue Phosphorescence via Coplanar Ligand Field

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Solution Overview

Problem

Existing iridium complexes with a weak ligand field are not effective as blue light-emitting materials due to insufficient π back donation, which limits their light emission characteristics.

Innovation Solution

An iridium complex with a specific ligand main skeleton featuring a pyrimidine ring, phenyl ring, and pyrazole ring, where the pyrimidine ring is ortho or para positioned on the phenyl ring and coplanar with it, enhancing π back donation and thus forming a strong ligand field, is developed.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Ease of manufacture

If a weak ligand field is used in the iridium complex, then the complex structure is simpler and easier to synthesize, but the light emission characteristics are insufficient and cannot achieve excellent blue light emission

Engineering Contradiction:
Improvecomplex synthesis easeVSAvoidlight emission characteristics
Core Design Contradiction:
Ease of manufactureVSReliability

Solution Approach 1:

The patent changes the ligand field strength parameter by introducing a specific coplanar structure where the pyrimidine ring is ortho or para positioned on the phenyl ring. This structural parameter change enhances π back donation from the iridium center to the ligand, transforming the weak ligand field into a strong ligand field, thereby achieving excellent blue light emission characteristics while maintaining structural feasibility

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The patent creates a composite ligand system combining pyrimidine ring, phenyl ring, and pyrazole ring in a specific coplanar arrangement. This composite structure synergistically enhances the ligand field strength through extended π-conjugation and optimized orbital overlap, enabling strong π back donation and excellent blue phosphorescence emission

Inventive Principle:
Principle #40Composite materials

2Ease of manufacture

If π back donation is insufficient in the iridium complex, then the ligand field remains weak and synthesis is easier, but the external quantum yield and light emission characteristics are poor

Engineering Contradiction:
Improvesynthesis easeVSAvoidexternal quantum yield
Core Design Contradiction:
Ease of manufactureVSUse of energy by moving object

Solution Approach 1:

The patent optimizes the π back donation parameter by designing a coplanar ligand structure with ortho or para positioning of the pyrimidine ring on the phenyl ring. This geometric parameter change maximizes orbital overlap between the iridium d-orbitals and ligand π*-orbitals, enhancing π back donation efficiency and achieving high external quantum yield for blue phosphorescence

Inventive Principle:
Principle #35Parameter changes

Applied Scientific Principles

This section explains which scientific principles are used to turn an abstract innovation direction into a practical engineering solution.

Function Achieved in This Case

The iridium complex exhibits excellent blue phosphorescence emission characteristics with a high external quantum yield, making it suitable for blue light-emitting materials and potentially as a host material for green or red light-emitting layers.

Implementation Method 1

The present invention provides an iridium complex which emits blue phosphorescence

Methodology Applied
Scientific EffectPhosphorescence: Phosphorescence

Data Source

PatentUS8986856B2Iridium complex and organic light-emitting element including the same
Publication Date: 2015.03.24 CANON KK
  • US8986856B2 patent drawing
  • US8986856B2 patent drawing
  • US8986856B2 patent drawing

AI summary

The present invention provides a novel iridium complex and an organic light-emitting element including the same. The novel iridium complex includes phenylpyrazole as a ligand and has a basic skeleton in which a pyrimidine ring is bonded to a phenyl ring.