3-[(2-Pyrimidinylsulfanyl)Acetyl]Benzenesulfonamide

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Properties Simple | Detailed

Formula C12H11N3O3S2
IUPAC Name 3-(2-pyrimidin-2-ylsulfanylacetyl)benzenesulfonamide
Molecular Mass 309.364 g·mol−1
Heat of Formation -187.6 ± 16.7 kJ·mol−1
Dipole Moment 7.11 ± 1.08 D
Volume 328.55 Å 3
Surface Area 305.85 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 1.86 ± eV
Point Group Symmetry C1
InChIKey BWAZRCOFUQSGBG-UHFFFAOYSA-N
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