2-Chlorocyclohexyl 2,4-Dinitrophenyl Sulfone

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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 -366.6 ± 16.7 kJ·mol−1
Dipole Moment 4.85 ± 1.08 D
Volume 346.93 Å 3
Surface Area 287.76 Å 2
HOMO Energy -11.11 ± 0.55 eV
LUMO Energy 0.69 ± eV
Point Group Symmetry C1
InChIKey GQLQCMKDSNJDKL-KOLCDFICSA-N
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