3-{[Trans-4-({2-[(2-Acetamidoethyl)Disulfanyl]Ethyl}Carbamoyl)Cyclohexyl]Carbamoyl}-2-Pyrazinecarboxylic Acid

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Formula C19H27N5O5S2
IUPAC Name 3-[[4-[2-(2-acetamidoethyldisulfanyl)ethylcarbamoyl]cyclohexyl]carbamoyl]pyrazine-2-carboxylic acid
Molecular Mass 469.578 g·mol−1
Heat of Formation -808.9 ± 16.7 kJ·mol−1
Dipole Moment 10.12 ± 1.08 D
Volume 545.75 Å 3
Surface Area 482.96 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 1.49 ± eV
Point Group Symmetry C1
InChIKey OMSKFAYIWROESZ-HDJSIYSDSA-N
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