5-Carbamothioyl-2-Nitrobenzoic Acid

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Properties Simple | Detailed

Formula C8H6N2O4S
IUPAC Name 5-carbamothioyl-2-nitro-benzoic acid
Molecular Mass 226.209 g·mol−1
Heat of Formation -187.8 ± 16.7 kJ·mol−1
Dipole Moment 6.38 ± 1.08 D
Volume 238.24 Å 3
Surface Area 226.54 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -1.98 ± eV
Point Group Symmetry C1
Synonyms
  • 2-nitro-5-thiocarbamoyl-benzoic acid
InChIKey FOXGLOGBTKVYIV-UHFFFAOYSA-N
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