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Metal free activation of water and ammonia by neutral tricoordinate pyramidal boron: a computational study
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Kalita, Amlan J. | - |
| dc.contributor.author | Purkayastha, Siddhartha K. | - |
| dc.contributor.author | Sarmah, Kangkan | - |
| dc.contributor.author | Konwar, Dimpul | - |
| dc.contributor.author | Guha, Ankur K. | - |
| dc.date.accessioned | 2023-06-02T01:40:33Z | - |
| dc.date.available | 2023-06-02T01:40:33Z | - |
| dc.date.created | 2022-10-28 | - |
| dc.date.issued | 2023-06 | - |
| dc.identifier.issn | 1040-0400 | - |
| dc.identifier.uri | https://scholarworks.bwise.kr/gachon/handle/2020.sw.gachon/88018 | - |
| dc.description.abstract | High-level ab-initio calculations show neutral tri-coordinate pyramidal boron centers P3B and As3B that can be used to activate H2O and NH3 molecule. The acidic center and the basic center of the pyramidal species are bonded, yet due to the spatial arrangement of the respective orbitals, they are forbidden to interact with each other. This bifunctional property is utilized to carry out the activation process of water and ammonia in a metal-free approach. | - |
| dc.language | 영어 | - |
| dc.language.iso | en | - |
| dc.publisher | SPRINGER/PLENUM PUBLISHERS | - |
| dc.relation.isPartOf | STRUCTURAL CHEMISTRY | - |
| dc.title | Metal free activation of water and ammonia by neutral tricoordinate pyramidal boron: a computational study | - |
| dc.type | Article | - |
| dc.type.rims | ART | - |
| dc.description.journalClass | 1 | - |
| dc.identifier.wosid | 000859621400002 | - |
| dc.identifier.doi | 10.1007/s11224-022-02060-5 | - |
| dc.identifier.bibliographicCitation | STRUCTURAL CHEMISTRY, v.34, no.3, pp.971 - 977 | - |
| dc.description.isOpenAccess | N | - |
| dc.identifier.scopusid | 2-s2.0-85138814998 | - |
| dc.citation.endPage | 977 | - |
| dc.citation.startPage | 971 | - |
| dc.citation.title | STRUCTURAL CHEMISTRY | - |
| dc.citation.volume | 34 | - |
| dc.citation.number | 3 | - |
| dc.contributor.affiliatedAuthor | Konwar, Dimpul | - |
| dc.type.docType | Article | - |
| dc.subject.keywordAuthor | Activation | - |
| dc.subject.keywordAuthor | Pyramidal boron | - |
| dc.subject.keywordAuthor | Theoretical | - |
| dc.subject.keywordPlus | N-H BOND | - |
| dc.subject.keywordPlus | FRUSTRATED LEWIS PAIR | - |
| dc.subject.keywordPlus | HETEROCYCLIC SILYLENE | - |
| dc.subject.keywordPlus | OXIDATIVE ADDITION | - |
| dc.subject.keywordPlus | SMALL MOLECULES | - |
| dc.subject.keywordPlus | HYDROGEN | - |
| dc.subject.keywordPlus | BORANE | - |
| dc.subject.keywordPlus | CLEAVAGE | - |
| dc.subject.keywordPlus | CATALYST | - |
| dc.subject.keywordPlus | CARBENE | - |
| dc.relation.journalResearchArea | Chemistry | - |
| dc.relation.journalResearchArea | Crystallography | - |
| dc.relation.journalWebOfScienceCategory | Chemistry, Multidisciplinary | - |
| dc.relation.journalWebOfScienceCategory | Chemistry, Physical | - |
| dc.relation.journalWebOfScienceCategory | Crystallography | - |
| dc.description.journalRegisteredClass | scie | - |
| dc.description.journalRegisteredClass | scopus | - |
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Related Researcher
- KONWAR, DIMPUL
- Engineering (Department of Materials Science & Engineering)