N,N,N-Trimethyl-3-(2,2,2-Trifluoro-1,1-Dihydroxyethyl)Anilinium

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Formula C11H15F3NO2+
IUPAC Name trimethyl-[3-(2,2,2-trifluoro-1,1-dihydroxy-ethyl)phenyl]ammonium
Molecular Mass 250.238 g·mol−1
Heat of Formation 909.6 ± 16.7 kJ·mol−1
Dipole Moment 0.78 ± 1.08 D
Volume 261.34 Å 3
Surface Area 242.77 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -2.99 ± eV
Point Group Symmetry C1
Synonyms
  • m-(n,n,n-trimethylammonio)-2,2,2-trifluoro-1,1-dihydroxyethylbenzene
  • trimethyl-[3-(2,2,2-trifluoro-1,1-dihydroxy-ethyl)phenyl]ammonium
  • trimethyl-[3-(2,2,2-trifluoro-1,1-dihydroxy-ethyl)phenyl]azanium
  • trimethyl-[3-(2,2,2-trifluoro-1,1-dihydroxyethyl)phenyl]ammonium
  • trimethyl-[3-(2,2,2-trifluoro-1,1-dihydroxyethyl)phenyl]azanium
InChIKey KGVDBJQLTHWAJF-UHFFFAOYSA-N
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