N-{4-[(3,5-Difluorophenyl)Sulfonyl]Benzyl}-6-Indolizinecarboxamide

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Properties Simple | Detailed

Formula C22H37F2N2O3S+
IUPAC Name n-[[4-(3,5-difluorocyclohexyl)sulfonylcyclohexyl]methyl]-1,2,3,5,7,8-hexahydroindolizine-1,2,3,5,6,7,8,8a-octaide-6-carboxamide
Molecular Mass 447.603 g·mol−1
Heat of Formation -449.7 ± 16.7 kJ·mol−1
Dipole Moment 2.22 ± 1.08 D
Volume 462.95 Å 3
Surface Area 414.43 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -1.53 ± eV
Point Group Symmetry Cs
InChIKey HRYUEDONVSHEJS-UHFFFAOYSA-N
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