5-(6-Bromohexanoylamino)-2-Nitro-Benzoic Acid

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Formula C13H15BrN2O5
IUPAC Name 5-(6-bromohexanoylamino)-2-nitro-benzoic acid
Molecular Mass 359.173 g·mol−1
Heat of Formation -548.3 ± 16.7 kJ·mol−1
Dipole Moment 7.28 ± 1.08 D
Volume 359.32 Å 3
Surface Area 334.52 Å 2
HOMO Energy -9.91 ± 0.55 eV
LUMO Energy 1.45 ± eV
Point Group Symmetry C1
InChIKey KJXRUICFDAEMEA-UHFFFAOYSA-N
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Elements H C O Br N