S-[(2S)-2-(2,4-Dinitroanilino)-3-Sulfanyl-Propanoyl]Sulfanyl (2S)-2-(2,4-Dinitroanilino)-3-Sulfanyl-Propanethioate

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Formula C18H16N6O10S4
IUPAC Name s-[(2s)-2-(2,4-dinitroanilino)-3-sulfanyl-propanoyl]sulfanyl (2s)-2-(2,4-dinitroanilino)-3-sulfanyl-propanethioate
Molecular Mass 604.614 g·mol−1
Heat of Formation -160.1 ± 16.7 kJ·mol−1
Dipole Moment 12.92 ± 1.08 D
Volume 627.92 Å 3
Surface Area 429.46 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy 1.38 ± eV
Point Group Symmetry C1
InChIKey WYLAIDKBTNVIMW-KBPBESRZSA-N
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