(3R,4R)-N-(3-Fluoro-4-Methoxyphenyl)-N'-[2-Fluoro-4-(2-Oxo-1(2H)-Pyridinyl)Phenyl]-1-(Methylsulfonyl)-3,4-Pyrrolidinedicarboxamide

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Properties Simple | Detailed

Formula C25H24F2N4O6S+
IUPAC Name (1r,3r,4r)-n4-(3-fluoro-4-methoxy-phenyl)-n3-[2-fluoro-4-(2-oxo-1-pyridyl)phenyl]-1-methylsulfonyl-pyrrolidine-3,4-dicarboxamide
Molecular Mass 546.543 g·mol−1
Heat of Formation -1084.1 ± 16.7 kJ·mol−1
Dipole Moment 7.25 ± 1.08 D
Volume 587.47 Å 3
Surface Area 512.88 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
InChIKey JORQWQCWRYRBEL-ROUUACIJSA-N
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