3,6-Bis(1H-Imidazol-4-Ylmethyl)Piperazine-2,5-Dione

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Properties Simple | Detailed

Formula C12H14N6O2
IUPAC Name (3r,6r)-3,6-bis(1h-imidazol-5-ylmethyl)piperazine-2,5-dione
Molecular Mass 274.279 g·mol−1
Heat of Formation -77.8 ± 16.7 kJ·mol−1
Dipole Moment 5.30 ± 1.08 D
Volume 314.51 Å 3
Surface Area 288.0 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy 0.09 ± eV
Point Group Symmetry C2
InChIKey DTWZALREPCVBIQ-NXEZZACHSA-N
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