5-Carbamoylsulfanyl-2-Nitro-Benzoic Acid

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Formula C8H6N2O5S
IUPAC Name 5-carbamoylsulfanyl-2-nitro-benzoic acid
Molecular Mass 242.209 g·mol−1
Heat of Formation -428.9 ± 16.7 kJ·mol−1
Dipole Moment 6.86 ± 1.08 D
Volume 247.3 Å 3
Surface Area 233.79 Å 2
HOMO Energy -9.94 ± 0.55 eV
LUMO Energy 1.01 ± eV
Point Group Symmetry C1
InChIKey ICTJPBKZRFALQU-UHFFFAOYSA-N
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