7-Chloro-5-(2-Fluorophenyl)-2-Oxo-2,3-Dihydro-1H-1,4-Benzodiazepine-3-Carboxylic Acid

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Formula C16H10ClFN2O3
IUPAC Name (3s)-7-chloro-5-(2-fluorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid
Molecular Mass 332.714 g·mol−1
Heat of Formation -420.5 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 347.82 Å 3
Surface Area 305.19 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
InChIKey AUMAPAHSHLMFGL-AWEZNQCLSA-N
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Elements C F H Cl O N