2-Chloro-4-[(2-Pyrimidinylsulfanyl)Acetyl]Benzenesulfonamide

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Properties Simple | Detailed

Formula C12H10ClN3O3S2
IUPAC Name 2-chloro-4-(2-pyrimidin-2-ylsulfanylacetyl)benzenesulfonamide
Molecular Mass 343.809 g·mol−1
Heat of Formation -217.9 ± 16.7 kJ·mol−1
Dipole Moment 5.25 ± 1.08 D
Volume 348.79 Å 3
Surface Area 318.65 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -1.54 ± eV
Point Group Symmetry C1
InChIKey ZQEDEEFNLDNUEW-UHFFFAOYSA-N
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