(1R,9S)-1-Hydroxy-5,5,9,11,11-Pentamethyltricyclo[7.3.1.0~2,7~]Tridec-2(7)-En-3-One

Molecule SVG Image

Properties Simple | Detailed

Formula C18H28O2
IUPAC Name (1r,9s)-1-hydroxy-5,5,9,11,11-pentamethyl-tricyclo[7.3.1.02,7]tridec-2(7)-en-3-one
Molecular Mass 276.414 g·mol−1
Heat of Formation -567.0 ± 16.7 kJ·mol−1
Dipole Moment 5.59 ± 1.08 D
Volume 367.01 Å 3
Surface Area 289.63 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
Synonyms
  • 0
  • 2
  • 3
  • 4
  • 5
  • c
  • i
  • n
  • z
InChIKey IJDSUFQMYUARCQ-QZTJIDSGSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O