2,2'-Disulfanediylbis(4-Acetyl-1,1-Dimethylpiperazin-1-Ium)

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Properties Simple | Detailed

Formula C16H32N4O2S2++
IUPAC Name 1-[(3s)-3-[[(2r)-4-acetyl-1,1-dimethyl-piperazin-1-ium-2-yl]disulfanyl]-4,4-dimethyl-piperazin-4-ium-1-yl]ethanone
Molecular Mass 376.581 g·mol−1
Heat of Formation 3063.7 ± 16.7 kJ·mol−1
Dipole Moment 7.71 ± 1.08 D
Volume 379.44 Å 3
Surface Area 333.32 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -2.20 ± eV
Point Group Symmetry C1
InChIKey GZTBUOYDBNSQIK-IYBDPMFKSA-N
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