(1R,9S)-3-Bromo-7,11-Diazatricyclo[7.3.1.0~2,7~]Trideca-2,4-Dien-6-One

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Formula C11H13BrN2O+
IUPAC Name (1r,9s)-3-bromo-7,11-diazatricyclo[7.3.1.0 2,7 ]trideca-2,4-dien-6-one
Molecular Mass 269.138 g·mol−1
Heat of Formation -56.0 ± 16.7 kJ·mol−1
Dipole Moment 5.65 ± 1.08 D
Volume 255.92 Å 3
Surface Area 226.41 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -0.24 ± eV
Point Group Symmetry C1
InChIKey QGUJDQNVLMZXLT-JGVFFNPUSA-N
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Elements H C O Br N