1-Phenylhepta-1,3,5-Triyn-7-Ol

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Properties Simple | Detailed

Formula C13H8O
IUPAC Name 7-phenylhepta-2,4,6-triyn-1-ol
Molecular Mass 180.202 g·mol−1
Heat of Formation 591.9 ± 16.7 kJ·mol−1
Dipole Moment 2.47 ± 1.08 D
Volume 231.39 Å 3
Surface Area 243.56 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -1.03 ± eV
Point Group Symmetry C1
Synonyms
  • 1-phtyo
  • 2,4,6-heptatriyn-1-ol, 7-phenyl-
  • 7-phenyl-2,4,6-heptatriyn-1-ol
CAS Number(s)
  • 60214-15-5
InChIKey OBLAWABLSMUERW-UHFFFAOYSA-N
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