1-[(1S,2R)-2-Chlorocyclohexyl]Sulfonyl-2,4-Dinitro-Benzene

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Properties Simple | Detailed

Formula C12H13ClN2O6S
IUPAC Name 1-[(1s,2r)-2-chlorocyclohexyl]sulfonyl-2,4-dinitro-benzene
Molecular Mass 348.759 g·mol−1
Heat of Formation -350.0 ± 16.7 kJ·mol−1
Dipole Moment 5.56 ± 1.08 D
Volume 350.75 Å 3
Surface Area 297.37 Å 2
HOMO Energy -10.79 ± 0.55 eV
LUMO Energy 0.58 ± eV
Point Group Symmetry C1
InChIKey ZBQSJNJRISSJMJ-KOLCDFICSA-N
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