5-Chloro-1,2-Benzoxazol-3(2H)-One

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Properties Simple | Detailed

Formula C7H4ClNO2
IUPAC Name 5-chloro-1,2-benzoxazol-3-one
Molecular Mass 169.565 g·mol−1
Heat of Formation -67.3 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 170.98 Å 3
Surface Area 173.16 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy 1.74 ± eV
Point Group Symmetry C1
Synonyms
  • 5-chloroindoxazen-3-one
InChIKey WIZWHBRFTCYPDN-UHFFFAOYSA-N
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Elements H C N O Cl