(2R)-2-Amino-3-(2,4,6-Trinitrophenyl)Sulfanyl-Propanoic Acid

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Properties Simple | Detailed

Formula C9H8N4O8S
IUPAC Name (2r)-2-amino-3-(2,4,6-trinitrophenyl)sulfanyl-propanoic acid
Molecular Mass 332.247 g·mol−1
Heat of Formation -243.4 ± 16.7 kJ·mol−1
Dipole Moment 1.97 ± 1.08 D
Volume 330.22 Å 3
Surface Area 290.85 Å 2
HOMO Energy -9.93 ± 0.55 eV
LUMO Energy -2.89 ± eV
Point Group Symmetry C1
InChIKey AKKLTRVJQPEONG-YFKPBYRVSA-N
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