3-Nitrobenzenesulfonic Acid

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Properties Simple | Detailed

Formula C6H5NO5S
IUPAC Name 3-nitrobenzenesulfonic acid
Molecular Mass 203.173 g·mol−1
Heat of Formation -447.0 ± 16.7 kJ·mol−1
Dipole Moment 3.98 ± 1.08 D
Volume 196.72 Å 3
Surface Area 194.4 Å 2
HOMO Energy -11.26 ± 0.55 eV
LUMO Energy -1.80 ± eV
Point Group Symmetry C1
Synonyms
  • 3-nitrobenzenesulphonic acid
  • 3-nitrophenylsulfonic acid
  • benzenesulfonic acid, 3-nitro-
  • benzenesulfonic acid, m-nitro-
  • m-nitrobenzenesulfonic acid
  • m-nitrobenzensulfonic acid
CAS Number(s)
  • 98-47-5
InChIKey ONMOULMPIIOVTQ-UHFFFAOYSA-N
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