2-Chloro-N-[(3R)-2-Oxo-1,2,3,4-Tetrahydro-3-Quinolinyl]-6H-Thieno[2,3-B]Pyrrole-5-Carboxamide

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Formula C16H12ClN3O2S
IUPAC Name 2-chloro-n-[(3r)-2-oxo-3,4-dihydro-1h-quinolin-3-yl]thieno[2,3-b]pyrrole-1,6-diium-5-carboxamide
Molecular Mass 345.803 g·mol−1
Heat of Formation -32.0 ± 16.7 kJ·mol−1
Dipole Moment 6.20 ± 1.08 D
Volume 373.6 Å 3
Surface Area 334.57 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 2.12 ± eV
Point Group Symmetry C1
Synonyms
  • 2-chloro-n-[(3r)-2-keto-3,4-dihydro-1h-quinolin-3-yl]-6h-thieno[3,2-d]pyrrole-5-carboxamide
  • 2-chloro-n-[(3r)-2-oxo-3,4-dihydro-1h-quinolin-3-yl]-6h-thieno[3,2-d]pyrrole-5-carboxamide
  • 3th
InChIKey LJAHIGGEXIWVJG-LLVKDONJSA-N
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