4-(1,3-Benzoxazol-2-Yl)-2,6-Dibromophenol

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Properties Simple | Detailed

Formula C13H7Br2NO2
IUPAC Name 4-(1,3-benzoxazol-2-yl)-2,6-dibromo-phenol
Molecular Mass 369.008 g·mol−1
Heat of Formation 35.1 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 296.19 Å 3
Surface Area 278.08 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy 1.70 ± eV
Point Group Symmetry Cs
InChIKey DMOJYCAJRLAKQW-UHFFFAOYSA-N
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Elements H C O Br N