A PM3 SCF-MO study of the structure and bonding in the cage systems S4N4 and S4N4X (X = N+, N−, S, N2S, P+, C, Si, B− and Al−)
Author:
Publisher
Elsevier BV
Subject
Materials Chemistry,Inorganic Chemistry,Physical and Theoretical Chemistry
Reference13 articles.
1. The Electronic Structure and Localized Molecular Orbitals in S4N4 by the CNDO/BW Theory
2. Electronic structure of the sulfur nitrides. Ab initio calculations and photoelectron spectra
3. Molecular orbital study of sulfur-nitrogen and sulfur-carbon conjugation: mode of bonding in (SN)x and related compounds
4. Optimization of parameters for semiempirical methods I. Method
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1. Analysis of the Explosive Properties of Tetrasulfur Tetranitride, S 4 N 4;Zeitschrift für anorganische und allgemeine Chemie;2021-01-25
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3. The origin and magnitude of intramolecular quasi-cyclic S⋯O and S⋯S interactions revisited: A computational study;Chemical Physics Letters;2015-07
4. From Eight‐Membered 10π Electron Sulfur–Nitrogen Cycles to Bicycles and Cages: A Theoretical Approach;Chemistry – A European Journal;2014-09-02
5. A Variable Temperature X-ray Diffraction Investigation of [PPN+][S4N5−]: Supramolecular Interactions Governing an Order/Disorder Transformation and the First High Resolution X-ray Structure of the Anion;Molecules;2014-02-12
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