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Photoelektronen-Spektren und Moleküleigenschaften, 110 [1,2]. Tricyanmethan-Derivate X—C(CN)3

Photoelectron spectra and molecular properties, 110 [1, 2]. Tricyanomethane derivatives X-C(CN)3

  • The photoelectron spectra of tricyanomethane derivatives X-C(CN)3 with substituents X = H, CH3, Br and C6H5 have been recorded and are assigned based on MNDO calculations as well as on radical cation state comparison with the iso(valence)electronic P(CN)3, within the series of cyanomethanes H4-nC(CN)n, and with each other. For HC(CN)3, no traces of the isomeric dicyano, ketimine HN = C=C(CN)2 are detected in the gas phase. Tricyanomethylbenzene, H5C6-C(CN)3, exhibiting the highest first ionization energy of any known singly acceptor substituted phenyl derivative, demonstrates the tremendous electron withdrawing effect of the -C(CN)3 group.

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Metadaten
Author:Hans BockGND, Ralph DammelGND
URN:urn:nbn:de:hebis:30:3-799786
DOI:https://doi.org/10.1515/znb-1987-0311
ISSN:1865-7117
ISSN:0932-0776
Parent Title (German):Zeitschrift für Naturforschung, B
Publisher:Verlag der Zeitschrift für Naturforschung
Place of publication:Tübingen
Document Type:Article
Language:German
Date of Publication (online):2014/06/02
Year of first Publication:1987
Publishing Institution:Universitätsbibliothek Johann Christian Senckenberg
Release Date:2024/01/11
Tag:MNDO Calculations; PE Spectra; Tricyanomethane Derivatives
Volume:42.1987
Issue:3
Page Number:8
First Page:315
Last Page:322
Institutes:Biochemie, Chemie und Pharmazie / Biochemie und Chemie
Dewey Decimal Classification:5 Naturwissenschaften und Mathematik / 54 Chemie / 540 Chemie und zugeordnete Wissenschaften
Sammlungen:Universitätspublikationen
Licence (German):License LogoCreative Commons - Namensnennung-Nicht kommerziell-Keine Bearbeitung 3.0