5-(4-Chloro-5-Phenyl-3-Thienyl)-1,2,5-Thiadiazolidin-3-One 1,1-Dioxide

Molecule SVG Image

Properties Simple | Detailed

Formula C12H9ClN2O3S2
IUPAC Name 5-(4-chloro-5-phenyl-3-thienyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
Molecular Mass 328.794 g·mol−1
Heat of Formation -276.5 ± 16.7 kJ·mol−1
Dipole Moment 3.02 ± 1.08 D
Volume 329.95 Å 3
Surface Area 287.5 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 1.92 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(4-chloro-5-phenyl-3-thienyl)-1,1-diketo-1,2,5-thiadiazolidin-3-one
  • 5-(4-chloro-5-phenyl-3-thienyl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
  • 5-(4-chloro-5-phenyl-thiophen-3-yl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
  • 5-(4-chloro-5-phenylthiophen-3-yl)-1,1-dioxo-1,2,5-thiadiazolidin-3-one
InChIKey LCPRWBWCEGWNKF-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N S