(2Z)-N-{[(2R)-1-Ethyl-2-Pyrrolidinyl]Methyl}-2-(2-Fluorobenzylidene)-3-Oxo-3,4-Dihydro-2H-1,4-Benzothiazine-6-Carboxamide

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Properties Simple | Detailed

Formula C23H24FN3O2S
IUPAC Name (2z)-n-[[(2r)-1-ethylpyrrolidin-2-yl]methyl]-2-[(2-fluorophenyl)methylidene]-3-oxo-4h-1,4-benzothiazine-6-carboxamide
Molecular Mass 425.519 g·mol−1
Heat of Formation -291.5 ± 16.7 kJ·mol−1
Dipole Moment 4.97 ± 1.08 D
Volume 496.99 Å 3
Surface Area 435.56 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
InChIKey SPCVDRWAFFUROT-OJSPLJLUSA-N
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