7-[(4As,6R,7As)-3,4,4A,5,7,7A-Hexahydro-2H-Pyrrolo[3,4-B][1,4]Oxazin-6-Yl]-8-Cyano-1-Cyclopropyl-6-Fluoro-4-Oxo-2,5-Dihydroquinoline-2,3,4A,5,6,7,8,8A-Octaide-3-Carboxylic Acid

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Formula C20H28FN4O4+
IUPAC Name 7-[(4as,6r,7as)-3,4,4a,5,7,7a-hexahydro-2h-pyrrolo[3,4-b][1,4]oxazin-6-yl]-8-cyano-1-cyclopropyl-6-fluoro-4-oxo-2,5-dihydroquinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 407.459 g·mol−1
Heat of Formation -361.2 ± 16.7 kJ·mol−1
Dipole Moment 4.73 ± 1.08 D
Volume 439.54 Å 3
Surface Area 370.56 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy 1.46 ± eV
Point Group Symmetry C1
InChIKey ZIXKNPXFAJGDGT-USKNVMQVSA-O
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