7-[(2R,4R)-2-(Aminomethyl)Morpholin-4-Yl]-1-Cyclopropyl-6,8-Difluoro-4-Oxo-2,5-Dihydroquinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C18H28F2N3O4+ |
IUPAC Name | (1r,3r,4ar,6r,7s,8s,8ar)-7-[(2r,4r)-2-(aminomethyl)morpholin-4-yl]-1-cyclopropyl-6,8-difluoro-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1h-quinolin-1-ium-3-carboxylic acid |
Molecular Mass | 388.429 g·mol−1 |
Heat of Formation | -748.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.30 ± 1.08 D |
Volume | 415.61 Å 3 |
Surface Area | 359.58 Å 2 |
HOMO Energy | -9.19 ± 0.55 eV |
LUMO Energy | -1.19 ± eV |
Point Group Symmetry | C1 |
InChIKey | FDLFKWYRIOGCNK-BOMKWMBMSA-O |
QR Code | Generate QR Code |
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Elements | H C N O F |