1-(4-Bromobenzoyl)-2,3-Piperazinedicarboxylic Acid

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Properties Simple | Detailed

Formula C13H13BrN2O5
IUPAC Name (2s,3s)-1-(4-bromobenzoyl)piperazine-2,3-dicarboxylic acid
Molecular Mass 357.157 g·mol−1
Heat of Formation -754.8 ± 16.7 kJ·mol−1
Dipole Moment 4.56 ± 1.08 D
Volume 341.23 Å 3
Surface Area 291.12 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
InChIKey WDVICMJSSBICSA-UWVGGRQHSA-N
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Elements H C O Br N