(2S,3Ar)-7-Chloro-2-Methyl-3,3A-Dihydro-2H,9H-[1,2]Oxazolo[3,2-B][1,3]Benzoxazin-9-One

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Formula C11H10ClNO3
IUPAC Name (2s,3ar)-7-chloro-2-methyl-3,3a-dihydro-2h-isoxazolo[3,2-b][1,3]benzoxazin-9-one
Molecular Mass 239.655 g·mol−1
Heat of Formation -301.2 ± 16.7 kJ·mol−1
Dipole Moment 5.26 ± 1.08 D
Volume 252.74 Å 3
Surface Area 233.82 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy -1.03 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3ar)-7-chloro-2-methyl-3,3a-dihydro-2h-[1,2]oxazolo[3,2-b][1,3]benzoxazin-9-one
  • (2s,3ar)-7-chloro-2-methyl-3,3a-dihydro-2h-isoxazolo[3,2-b][1,3]benzoxazin-9-one
InChIKey OJGJQQNLRVNIKE-QUBYGPBYSA-N
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Elements H C N O Cl