6-Chloro-3-(3-Cyclopropyl-1,2,4-Oxadiazol-5-Yl)-5-Methylimidazo(1,5-A)Quinoxalin-4(5H)-One

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Properties Simple | Detailed

Formula C16H12ClN5O2
IUPAC Name 6-chloro-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5-methyl-imidazo[1,5-a]quinoxalin-10-ium-3a-ylium-4-one
Molecular Mass 341.752 g·mol−1
Heat of Formation 329.3 ± 16.7 kJ·mol−1
Dipole Moment 6.66 ± 1.08 D
Volume 358.64 Å 3
Surface Area 324.63 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -1.60 ± eV
Point Group Symmetry C1
Synonyms
  • 6-chloro-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5-methyl-4-imidazo[5,1-c]quinoxalinone
  • 6-chloro-3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5-methyl-imidazo[5,1-c]quinoxalin-4-one
InChIKey XJEIMDYZJFFAQB-UHFFFAOYSA-N
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Elements H C N O Cl