Wechselwirkungen in Kristallen, 35 [1, 2]. Einkristallzüchtung von Na⊕⊖C(NO2)3 [***] aus Etherlösungen zu einem polymeren Band [(Na⊕⊖C(NO2)3) Dioxan]∞ und einem Lösungsmittel-getrennten Ionenpaar [(Na⊕/18-Krone-6)(THF)2]⊕[(Na⊕/18-Krone-6)(ONO-C⊖(NO2)2)2]⊖

Interactions in Crystals, 35 [1, 2]. Single Crystal Growths of Na⊕⊖C(NO2)3[***] from Ether Solutions to a Polymer Band [(Na⊕⊖C(NO2)3)Dioxane]∞ and to a Solvent-Separated Ion Pair [(Na⊕/18-Crown-6)(THF)2]⊕[(Na⊕/18-Crown-6)(ONO-C⊖(NO2)2)2]⊖

  • The sodium salt of the most simple polynitro-substituted hydrocarbon anion. Na⊕⊖C(NO2)3, (for a hazard warning cf. [***]) crystallizes from ether solutions without and with addition of 18-crown-6 either in a polymer band. [(Na⊕⊖C(NO2)3)dioxane]∞, or as a solvent- separated ion pair, [(Na⊕/18-crown-6)(THF2]⊕[(Na⊕/18-crown-6)(O2N-C⊖(NO2)2)2]⊖. The Na⊕ cations are each 8-fold coordinated in hexagonal bipyramidal arrangement. According to extensive quantum-chemical calculations based on the structure coordinates, the formation of these novel salts can be traced back to the charge distribution in the anions ⊖C(NO2)3. which due to negatively charged oxygen centers are favorable complex ligands. The structure determining effects of solvation are discussed.

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Metadaten
Author:Hans BockGND, Tim Hauck, Christian NätherORCiDGND, Zdenek HavlasORCiD
URN:urn:nbn:de:hebis:30:3-816673
DOI:https://doi.org/10.1515/znb-1994-0802
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:1994
Publishing Institution:Universitätsbibliothek Johann Christian Senckenberg
Release Date:2024/01/22
Tag:MNDO Calculations; Single Crystal Structure; Solvation Effects
Volume:49.1994
Issue:8
Page Number:9
First Page:112
Last Page:120
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