(3S)-3-(3-Pyridinyl)-1H-Pyrrolo[1,2-C][1,3]Thiazole-7-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C12H11N3OS
IUPAC Name (3s)-3-(3-pyridyl)-1,3-dihydropyrrolo[1,2-c]thiazol-4-ium-7a-ylium-7-carboxamide
Molecular Mass 245.300 g·mol−1
Heat of Formation 100.1 ± 16.7 kJ·mol−1
Dipole Moment 3.42 ± 1.08 D
Volume 277.84 Å 3
Surface Area 252.37 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-3-(3-pyridyl)-1,3-dihydropyrrolo[1,2-c]thiazole-7-carboxamide
  • (3s)-3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazole-7-carboxamide
  • 1h,3h-pyrrolo[1,2-c]thiazole-7-carboxamide, 3-(3-pyridinyl)-, (3s)-
  • rp 55779
InChIKey ARFOASMERCHFBY-LBPRGKRZSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N