2-Benzyl-1,3,2-Benzodithiazole 1-Oxide

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Formula C13H11NOS2
IUPAC Name (1r,2s)-2-benzyl-1λ4,3,2-benzodithiazole 1-oxide
Molecular Mass 261.363 g·mol−1
Heat of Formation 130.5 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 290.7 Å 3
Surface Area 240.5 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 2.35 ± eV
Point Group Symmetry C1
InChIKey HJBJVVJKXTUDQZ-QGZVFWFLSA-N
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