1-[4-(9-Benzyl-9H-Fluoren-9-Yl)-2-Butyn-1-Yl]Azepane

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Properties Simple | Detailed

Formula C30H31N
IUPAC Name 1-[4-(9-benzylfluoren-9-yl)but-2-ynyl]azepane
Molecular Mass 405.574 g·mol−1
Heat of Formation 456.7 ± 16.7 kJ·mol−1
Dipole Moment 1.61 ± 1.08 D
Volume 535.04 Å 3
Surface Area 382.77 Å 2
HOMO Energy -8.31 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[4-[9-(benzyl)fluoren-9-yl]but-2-ynyl]azepane
  • 1-[4-[9-(phenylmethyl)-9-fluorenyl]but-2-ynyl]azepane
  • 1-[4-[9-(phenylmethyl)fluoren-9-yl]but-2-ynyl]azepane
  • ucl 1608
InChIKey ZKLIBSYZMKSRJE-UHFFFAOYSA-N
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Elements H C N