(~3~H_3_)Methyl (1R,2S,3S,5S)-3-(4-Iodophenyl)-8-Methyl-8-Azabicyclo[3.2.1]Octane-2-Carboxylate
Properties
Property | Value |
---|---|
Formula | C16H20INO2 |
IUPAC Name | methyl (1r,3r,4s,5s,8r)-3-(4-iodophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate |
Molecular Mass | 385.240 g·mol−1 |
Heat of Formation | -224.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.88 ± 1.08 D |
Volume | 370.88 Å 3 |
Surface Area | 312.33 Å 2 |
HOMO Energy | -8.74 ± 0.55 eV |
LUMO Energy | -0.17 ± eV |
Point Group Symmetry | C1 |
InChIKey | SIIICDNNMDMWCI-QPSCCSFWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | I H C O N |