9-Isothiocyanatoacridine

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Properties Simple | Detailed

Formula C14H8N2S
IUPAC Name 9-isothiocyanatoacridine
Molecular Mass 236.292 g·mol−1
Heat of Formation 469.4 ± 16.7 kJ·mol−1
Dipole Moment 0.86 ± 1.08 D
Volume 268.82 Å 3
Surface Area 255.61 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -2.16 ± eV
Point Group Symmetry C1
Synonyms
  • 9-acridinyl isothiocyanate
  • acridine, 9-isothiocyanato-
  • isothiocyanatoacridine
  • isothiocyanic acid, 9-acridinyl ester
CAS Number(s)
  • 7620-46-4
InChIKey NLSUMBWPPJUVST-UHFFFAOYSA-N
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