Synthesis, crystal structure and Hirshfeld analysis of triphenylphosphine-(4-bromophenyl)borane.
Sign Up to like & getrecommendations! Published in 2022 at "Acta crystallographica. Section C, Structural chemistry"
DOI: 10.1107/s2053229622010002
Abstract: The title compound, alternatively called (4-bromophenyl)dihydrido(triphenylphosphanyl)boron, C24H21BBrP, crystallizes in the space group P-1 with one symmetry-independent molecule in the asymmetric unit. The B and P atoms both adopt the expected tetrahedral geometry. A possible intramolecular… read more here.
Keywords: hirshfeld analysis; borane; synthesis crystal; bromophenyl ... See more keywords
Hirshfeld analysis and molecular docking with the RDR enzyme of 2-(5-chloro-2-oxoindolin-3-ylidene)-N-methylhydrazinecarbothioamide
Sign Up to like & getrecommendations! Published in 2017 at "Acta Crystallographica Section E: Crystallographic Communications"
DOI: 10.1107/s2056989017005461
Abstract: The title isatin thiosemicarbazone derivative is an intermediate in the synthetic pathway of HIV-1 reverse transcriptase inhibitors. A molecular docking evaluation of the title compound with the ribonucleoside diphosphate reductase (RDR) enzyme was carried out. read more here.
Keywords: hirshfeld analysis; rdr enzyme; docking rdr; analysis molecular ... See more keywords
Crystal structure and Hirshfeld analysis of 2-(5-bromothiophen-2-yl)acetonitrile
Sign Up to like & getrecommendations! Published in 2018 at "Acta Crystallographica Section E: Crystallographic Communications"
DOI: 10.1107/s2056989018000968
Abstract: The crystal structure of 2-(5-bromothiophen-2-yl)acetonitrile, previously reported as a liquid, has short centrosymmetric Type I Br⋯Br halogen interactions. read more here.
Keywords: crystal structure; hirshfeld analysis; bromothiophen acetonitrile; structure hirshfeld ... See more keywords
Crystal structure and Hirshfeld analysis of (1aS,3aR,4aS,5aR)-15-acetoxylinden-7(11),8-trieno-12,8-lactone
Sign Up to like & getrecommendations! Published in 2022 at "Acta Crystallographica Section E: Crystallographic Communications"
DOI: 10.1107/s2056989022004625
Abstract: The title compound, isolated from the Chloranthus japonicus Sieb., is a typical lindenane-type sesquiterpenoid. Hirshfeld surface analysis illustrates that the most important contributions are from O⋯H/H⋯O contacts (34.6%). read more here.
Keywords: hirshfeld analysis; analysis 1as; 1as 3ar; 3ar 4as ... See more keywords