Fluorinated Scorpionate Copper(I) Complex for Ethylene Separation

Resolve Bottlenecks,
Find Innovative Solutions
Generate Solutions

Solution Overview

Problem

Current methods for separating ethylene from ethane and propylene from propane are energy-intensive and inefficient, particularly relying on cryogenic distillation, which is costly and environmentally unsustainable.

Innovation Solution

Development of a fluorinated bis(pyrazolyl)borate ligand-supported copper(I) complex, {[(CF3)2Bp]Cu}3, that selectively binds ethylene over ethane and propylene, enabling efficient separation through reversible ethylene binding and desorption, facilitating high-purity ethylene and propylene recovery without the need for cryogenic distillation.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Reliability

If cryogenic distillation is used to separate ethylene from ethane, then separation is achieved, but energy consumption is high and operational costs increase

Engineering Contradiction:
Improveseparation effectivenessVSAvoidenergy consumption
Core Design Contradiction:
ReliabilityVSUse of energy by moving object

Solution Approach 1:

The invention changes the separation mechanism from physical distillation based on volatility differences to chemical binding based on selective coordination. The copper(I) complex changes its binding parameters to preferentially bind ethylene over ethane through the fluorinated scorpionate ligand, enabling separation at ambient conditions rather than cryogenic temperatures, thus dramatically reducing energy consumption while maintaining high separation effectiveness

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The invention replaces the mechanical distillation system with a chemical binding system. Instead of using physical processes (distillation columns, temperature gradients, phase changes), the system uses chemical coordination between copper(I) centers and ethylene molecules, substituting a mechanical/physical separation approach with a chemical recognition approach that is inherently more selective and energy-efficient

Inventive Principle:
Principle #28Mechanics substitution (Replace mechanical system)

2Reliability

If conventional distillation columns are used, then ethylene purification is achieved, but device complexity and capital costs increase

Engineering Contradiction:
Improvepurification qualityVSAvoiddistillation column complexity
Core Design Contradiction:
ReliabilityVSDevice complexity

Solution Approach 1:

The invention extracts the essential separation function from the complex distillation column system and concentrates it into a simple molecular complex. The copper(I) complex with fluorinated scorpionate ligand performs the entire separation function in a single molecular entity, eliminating the need for multi-tray distillation columns, condensers, reboilers, and associated control systems, thus dramatically simplifying the device while maintaining high purification quality

Inventive Principle:
Principle #2Taking out (Extraction)

Solution Approach 2:

The invention applies local quality by designing the ligand with specific fluorinated groups at particular positions to create localized electronic environments that enhance ethylene binding. The scorpionate ligand structure with N^N^O donor atoms creates a specific coordination geometry around copper that is locally optimized for ethylene recognition, enabling high selectivity without requiring complex overall system architecture

Inventive Principle:
Principle #3Local quality

3Reliability

If copper-based ethylene complexes are designed for high selectivity, then binding affinity increases, but air sensitivity and thermal stability worsen

Engineering Contradiction:
Improveethylene binding selectivityVSAvoidair sensitivity
Core Design Contradiction:
ReliabilityVSStability of the object's composition

Solution Approach 1:

The invention creates a composite molecular structure combining copper(I) center, fluorinated scorpionate ligand, and coordinated ethylene. The ligand acts as a protective shell that stabilizes the air-sensitive copper(I) center while maintaining ethylene binding capability. The composite structure integrates multiple functions: the ligand provides steric protection from oxygen, electronic stabilization of Cu(I), and maintains the coordination site for ethylene, thus achieving both high selectivity and improved stability

Inventive Principle:
Principle #40Composite materials

Solution Approach 2:

The fluorinated scorpionate ligand creates an inert coordination environment around the copper(I) center, protecting it from oxidation by air. The ligand's strong field N^N^O donors create a stable coordination sphere that excludes oxygen and other interfering species, effectively creating a molecular-level inert atmosphere that preserves both the Cu(I) state and bound ethylene, thus improving air sensitivity and thermal stability without compromising binding selectivity

Inventive Principle:
Principle #39Inert atmosphere (Inert environment)

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 complex achieves record-high selectivity for ethylene/ethane separation, allowing for >99.5% pure ethylene recovery and demonstrating effective separation of propylene from propane, reducing energy consumption and operational costs while maintaining high purity.

Implementation Method 1

copper is the cofactor in this protein, which binds ethylene quite tightly (Kd=2.4×10−9 M and a half-life for ethylene dissociation of 12.5 h)

Methodology Applied
Scientific EffectCoordination chemistry: Chemical Bonding

Implementation Method 2

enabling efficient separation through reversible ethylene binding and desorption

Methodology Applied
Scientific EffectReversible binding: Adsorption

Data Source

PatentUS20240309023A1Molecular sorbent compositions and methods of use thereof
Publication Date: 2024.09.19 BOARD OF RGT THE UNIV OF TEXAS SYST
  • US20240309023A1 patent drawing
  • US20240309023A1 patent drawing
  • US20240309023A1 patent drawing

AI summary

Provided herein is a molecular sorbent based on copper that provides high-purity separation, such as separation of ethylene from ethylene-ethane mixtures and propylene from propylene-propane mixtures. Further provided herein are compositions thereof, methods of manufacturing these, and methods of use thereof.