7-(2-Carboxy-5,6-Dihydroimidazo[1,2-A]Pyrazin-7(8H)-Yl)-1-Cyclopropyl-8-Methyl-6-Nitro-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C21H19N5O7
IUPAC Name 7-[(7r)-2-carboxy-6,8-dihydro-5h-imidazo[1,2-a]pyrazin-7-yl]-1-cyclopropyl-8-methyl-6-nitro-4-oxo-quinoline-3-carboxylic acid
Molecular Mass 453.405 g·mol−1
Heat of Formation -426.2 ± 16.7 kJ·mol−1
Dipole Moment 8.02 ± 1.08 D
Volume 488.66 Å 3
Surface Area 409.06 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -2.17 ± eV
Point Group Symmetry C1
InChIKey AERQOYCYAKKGNS-UHFFFAOYSA-N
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