2-(3-Chloro-6-{[2,2-Difluoro-2-(1-Oxido-2-Pyridinyl)Ethyl]Amino}-1-Oxido-2-Pyridinyl)-N-[1-(3-Chlorophenyl)Ethyl]Acetamide

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Properties Simple | Detailed

Formula C22H32Cl2F2N4O3++
IUPAC Name 2-[3-chloro-6-[[2,2-difluoro-2-(1-oxidopiperidine-2,3,4,5,6-pentaid-2-yl)ethyl]amino]-1-oxido-piperidine-2,3,4,5,6-pentaid-2-yl]-n-[(1r)-1-(3-chlorophenyl)ethyl]acetamide
Molecular Mass 509.417 g·mol−1
Heat of Formation -495.4 ± 16.7 kJ·mol−1
Dipole Moment 1.32 ± 1.08 D
Volume 504.32 Å 3
Surface Area 371.63 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 1.85 ± eV
Point Group Symmetry C1
InChIKey ISTCYDGUBPNUDF-CQSZACIVSA-N
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