Electronic and structural properties of borazine and related molecules
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- Type
- article
- Published
- 1984-11-30
- Cited by
- 40
- References
- 17
- OpenAlex
- https://openalex.org/W1967506070
- Semantic Scholar
- https://api.semanticscholar.org/CorpusID:93278547
Keywords
Borazine, Chemistry, Ring (chemistry), Delocalized electron, Computational chemistry
References
- Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I
- Electronic Population Analysis on LCAO–MO Molecular Wave Functions. II. Overlap Populations, Bond Orders, and Covalent Bond Energies
- An abinitio and ion cyclotron resonance study of the protonation of borazine
- Line intensities in 10B nuclear quadrupole double resonance spectra
- Virial partitioning of polyatomic systems
- Orbital energie and charge densities in borazine
- The characterization of atomic interactions
- Definition of bond paths and bond directions in terms of the molecular charge distribution
- AB initio calculations of 2H and 14N quadrupolar coupling constants in hydrogen bonded dimers
- Nuclear Spins and Moments
- Molecular orbital theory of the electronic structure of organic compounds. X. Systematic study of geometries and energies of AHn molecules and cations
- Structure of borazine
- Semiempirical self-consistent field-molecular orbitals calculations, employing complete valence orbital basis sets, for methyl-substituted borazines and benzenes
- Bonded and nonbonded charge concentrations and their relation to molecular geometry and reactivity
- Calculation of the average properties of atoms in molecules. II
- Cluster expansion of the wavefunction. Ionization potentilals of benzene
- Metal derivatives of the borazines. Ring complexes
Cited by
- Electronic and optical properties of pristine and boron-nitrogen doped graphyne nanotubes.
- Ab initio Determination of the Equilibrium Geometry and Vibrational Frequencies of Borazine
- Bond critical points in the electronic structures of the main group diatomic hydrides of lithium through bromine
- A comparative study of the bonding in heteroatom analogues of benzene
- On the bonding in π-complexes of borazine
- Binuclear 1,2-diaza-3,5-diborolyl iron carbonyls: Effect of replacing ring CC units with isoelectronic BN units
- Localization effects in the Auger spectra of ring nitrogen systems: Pyridine, poly(2‐vinyl)pyridine, borazine, and boron nitride
- Vibronic interactions in 6 and 18hetero(A,B)annulenes
- Theoretical study of borazine and substituted borazines using density functional theory method
- Angular group‐induced bond alternation (AGIBA). Part 5—Conformation dependence and additivity of the effect: structural studies of 3,5‐dimethoxybenzaldehyde derivatives and related systems
- Hyperconjugation as a driving force for the different conformation of symmetric triethyl derivatives of boroxin, borazine, benzene and triazine
- Stepwise assembly and structural characterization of oligonuclear ferrocene aggregates with boron-nitrogen backbone
- Aromaticity of Benzenoid-Borazinoid Hybrids: Current Maps for Hetero-Graphenes
- Pristine and BN doped graphyne derivatives for UV light protection
- Dynamic properties and structure formation of boron and carbon nitrides
- Polarizability and magnetizability anisotropies of trimethylboroxine, Me3B3O3.: Comparison of boroxine and benzene ring systems
- Borazine: to be or not to be aromatic
- Understanding the properties of inorganic benzenes based on π-electron densities.
- Theoretical determination of structural parameters for s-triazine and some derivatives. Comparison between ab initio and semi-empirical calculations
- Melem- and melamine-derived iminophosphoranes
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