4-Bromo-6-Nitro-2-Piperazin-1-Yl-Quinolin-1-Ium-4A-Ide

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Properties Simple | Detailed

Formula C13H14BrN4O2
IUPAC Name 4-bromo-6-nitro-2-piperazin-1-yl-quinolin-1-ium-4a-ide
Molecular Mass 338.180 g·mol−1
Heat of Formation 244.3 ± 16.7 kJ·mol−1
Dipole Moment 9.31 ± 1.08 D
Volume 323.5 Å 3
Surface Area 294.47 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -1.43 ± eV
Point Group Symmetry C1
InChIKey FPPNWIZUIXCAOM-UHFFFAOYSA-N
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Elements H C O Br N