4-{[(5-Butyl-2-Pyrimidinyl)Sulfanyl]Acetyl}Benzenesulfonamide

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Properties Simple | Detailed

Formula C16H19N3O3S2
IUPAC Name 4-[2-(5-butylpyrimidin-2-yl)sulfanylacetyl]benzenesulfonamide
Molecular Mass 365.470 g·mol−1
Heat of Formation -288.9 ± 16.7 kJ·mol−1
Dipole Moment 6.24 ± 1.08 D
Volume 415.74 Å 3
Surface Area 383.93 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -1.58 ± eV
Point Group Symmetry C1
InChIKey CLDNCMHZQXFDJO-UHFFFAOYSA-N
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