Methyl (1R,2S,3S,5S)-3-(3,4-Dichlorophenyl)-8-Azabicyclo[3.2.1]Octane-2-Carboxylate
Properties
Property | Value |
---|---|
Formula | C15H17Cl2NO2 |
IUPAC Name | methyl (1r,2s,3s,5s)-3-(3,4-dichlorophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate |
Molecular Mass | 314.207 g·mol−1 |
Heat of Formation | -339.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.17 ± 1.08 D |
Volume | 347.79 Å 3 |
Surface Area | 292.15 Å 2 |
HOMO Energy | -9.57 ± 0.55 eV |
LUMO Energy | -0.75 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
CAS Number(s) |
|
InChIKey | JFUNLJPTPCQLIR-PJQZNRQZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |