Substituted Cyclosilane Synthesis via Halogenated Precursor

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Solution Overview

Problem

Current methods for producing cyclosilane compounds face challenges such as high costs of reactants, complex and low-yielding processes, undesirable byproducts, and difficulty in isolating pure products, which hinder widespread production and implementation.

Innovation Solution

A method involving the combination of halogenated cyclosilane, tri-alkyl or tri-aryl silane, and a complexing agent like ammonium or phosphonium halide in a solvent, followed by agitation and separation, to produce substituted cyclosilane, facilitating a one-step synthesis with high purity and avoiding metal hydride constituents and silane gas byproducts.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Productivity

If conventional methods are used to produce cyclosilane, then production can proceed with existing processes, but the process becomes complex with low yield and high cost

Engineering Contradiction:
Improveproduction yieldVSAvoidprocess complexity
Core Design Contradiction:
ProductivityVSDevice complexity

Solution Approach 1:

The conventional multi-step process is segmented into a single reaction step by using the halogenated cyclosilane as a pre-functionalized starting material, eliminating intermediate purification and complex reaction sequences while maintaining high yield

Inventive Principle:
Principle #1Segmentation

Solution Approach 2:

The cyclosilane is pre-halogenated before the main reaction, preparing it in advance with reactive functional groups that enable direct substitution without requiring complex in-situ generation steps during the actual synthesis

Inventive Principle:
Principle #10Preliminary action

2Manufacturing precision

If conventional synthesis methods are used, then existing reactants can be employed, but undesirable byproducts are generated and product isolation becomes difficult

Engineering Contradiction:
Improveproduct purityVSAvoidbyproduct formation
Core Design Contradiction:
Manufacturing precisionVSObject-generated harmful factors

Solution Approach 1:

The halogen atoms on the cyclosilane, which could be considered harmful impurities, are converted into beneficial reactive sites that enable selective substitution reactions, allowing the same functional groups to serve both as reaction handles and as indicators of reaction progress

Inventive Principle:
Principle #22Blessing in disguise (Convert harm into benefit)

Solution Approach 2:

The halogenated cyclosilane acts as an intermediary compound that facilitates the reaction between the cyclosilane framework and the desired substituent, enabling clean transformation without generating complex byproduct mixtures

Inventive Principle:
Principle #24Intermediary (Mediator)

3Ease of manufacture

If liquid precursor is used for silicon manufacturing, then deposition is easier, but producing the liquid precursor itself becomes challenging

Engineering Contradiction:
Improvedeposition easeVSAvoidprecursor production complexity
Core Design Contradiction:
Ease of manufactureVSDevice complexity

Solution Approach 1:

The synthesis of the liquid precursor is merged with the deposition process itself by using the halogenated cyclosilane as both the precursor material and the reaction substrate, eliminating the need for separate precursor synthesis facilities

Inventive Principle:
Principle #5Merging (Combining)

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

This method enables the production of high-purity substituted cyclosilane with yields greater than 90%, simplifies the synthesis process, and allows for scalability to commercial quantities by eliminating complex steps and byproducts.

Implementation Method 1

the halogenated cyclosilane reacting to produce the substituted cyclosilane

Methodology Applied
Scientific EffectChemical substitution reaction: Chemical Bonding

Implementation Method 2

a complexing agent including at least one of ammonium halide or phosphonium halide

Methodology Applied
Scientific EffectComplexation: Chemical Bonding

Implementation Method 3

the agitating includes stirring

Methodology Applied
Scientific EffectStirring: Stirring

Implementation Method 4

the separating includes distillation

Methodology Applied
Scientific EffectDistillation: Distillation

Data Source

PatentUS12030781B2Method of preparing cyclosilane
Publication Date: 2024.07.09 CORETEC GROUP INC
  • US12030781B2 patent drawing
  • US12030781B2 patent drawing

AI summary

A method includes producing a substituted cyclosilane by combining in a solvent the following: (i) halogenated cyclosilane, (ii) at least one of tri-alkyl or tri-aryl silane, and (iii) a complexing agent that includes at least one of ammonium halide or phosphonium halide. The halogenated cyclosilane reacts to produce the substituted cyclosilane.