9-(3,4,5-Triphenyl-1H-Pyrazol-1-Yl)Nonanoic Acid

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Properties Simple | Detailed

Formula C30H32N2O2
IUPAC Name 9-(3,4,5-triphenylpyrazol-1-ium-3-ylium-1-yl)nonanoate
Molecular Mass 452.587 g·mol−1
Heat of Formation 1025.9 ± 16.7 kJ·mol−1
Dipole Moment 24.30 ± 1.08 D
Volume 569.53 Å 3
Surface Area 435.42 Å 2
HOMO Energy -6.90 ± 0.55 eV
LUMO Energy -4.58 ± eV
Point Group Symmetry C1
Synonyms
  • 3,4,5-tpna
  • 3,4,5-triphenyl-1h-pyrazole-1-nonanoic acid
  • 9-[3,4,5-tri(phenyl)-1-pyrazolyl]nonanoic acid
  • 9-[3,4,5-tri(phenyl)pyrazol-1-yl]nonanoic acid
  • 9-[3,4,5-tri(phenyl)pyrazol-1-yl]pelargonic acid
CAS Number(s)
  • 134701-70-5
InChIKey UQKNBUMTTCHIOJ-UHFFFAOYSA-N
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