Dibenzyl sulfide at 150 K

Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

Abstract

The mol-ecule of the title compound, C14H14S, lies on a crystallographic twofold axis running through the central S atom, and hence mol-ecules have exact C-2 mol-ecular symmetry. Density-functional theory calculations reveal that the energy-optimized mol-ecular structure in the gas phase is close to that observed in the crystal structure. The crystal packing is dominated by double chains running along the c axis formed by C-(HS)-S-... inter-actions.

Detaljer

Författare
  • Christian Hansson
Enheter & grupper
Forskningsområden

Ämnesklassifikation (UKÄ) – OBLIGATORISK

  • Organisk kemi
Originalspråkengelska
Sidor (från-till)O2377-O2379
TidskriftActa Crystallographica Section E: Structure Reports Online
Volym62
Utgåva nummer6
StatusPublished - 2006
PublikationskategoriForskning
Peer review utfördJa