3,4-Dihydro-2H,6H-[1,3]Thiazino[3,2-B]Isoquinolin-6-One

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Properties Simple | Detailed

Formula C12H11NOS+
IUPAC Name 3,4-dihydro-2h-[1,3]thiazino[3,2-b]isoquinolin-6-one
Molecular Mass 217.287 g·mol−1
Heat of Formation -30.5 ± 16.7 kJ·mol−1
Dipole Moment 2.68 ± 1.08 D
Volume 245.02 Å 3
Surface Area 228.1 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • 2h,6h-(1,3)thiazino(3,2-b)isoquinolin-6-one, 3,4-dihydro-
  • 3,4-dihydro-2h,6h-(1,3)thiazino(3,2-b)isoquinolin-6-one
  • 6-oxo-3,4-dihydro-2h,6h-1,3-thiazino(3,2-b)isoquinoline
  • thiazinoisoquinolone
CAS Number(s)
  • 67755-06-0
InChIKey LNKBYMKMJSTWOH-UHFFFAOYSA-N
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