N-[(3R)-1-Azabicyclo[2.2.2]Oct-3-Yl]-6-Chloro-4-Methyl-3-Oxo-3,4-Dihydro-2H-1,4-Benzoxazine-8-Carboxamide
Properties
Property | Value |
---|---|
Formula | C17H20ClN3O3 |
IUPAC Name | 6-chloro-4-methyl-3-oxo-n-[(3r)-quinuclidin-3-yl]-1,4-benzoxazine-8-carboxamide |
Molecular Mass | 349.812 g·mol−1 |
Heat of Formation | -426.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.18 ± 1.08 D |
Volume | 393.6 Å 3 |
Surface Area | 339.35 Å 2 |
HOMO Energy | -9.00 ± 0.55 eV |
LUMO Energy | -1.00 ± eV |
Point Group Symmetry | C1 |
InChIKey | WUKZPHOXUVCQOR-ZDUSSCGKSA-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 |