2-Methyl-3-Oxo-2-Azabicyclo[2.2.2]Oct-6-Yl 5-(4-Biphenylyl)-3-Methylpentanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C26H31NO3
IUPAC Name [(1s,4r,6r)-2-methyl-3-oxo-2-azabicyclo[2.2.2]octan-6-yl] (3r)-3-methyl-5-(4-phenylphenyl)pentanoate
Molecular Mass 405.529 g·mol−1
Heat of Formation -505.1 ± 16.7 kJ·mol−1
Dipole Moment 3.85 ± 1.08 D
Volume 508.77 Å 3
Surface Area 389.11 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 0.15 ± eV
Point Group Symmetry C1
InChIKey BGUQHXXOAZWWLI-UFONIEFXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N