(1R)-3-[2-(4-Azido-3-Iodo-Phenyl)Ethyl]-8-[4-(4-Fluorophenyl)-4-Oxo-Butyl]-1-Phenyl-1,3,8-Triazaspiro[4.5]Decan-4-One

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Formula C31H33FIN6O2
IUPAC Name (1r)-3-[2-(4-azido-3-iodo-phenyl)ethyl]-8-[4-(4-fluorophenyl)-4-oxo-butyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Molecular Mass 667.536 g·mol−1
Heat of Formation 136.4 ± 16.7 kJ·mol−1
Dipole Moment 6.72 ± 1.08 D
Volume 692.76 Å 3
Surface Area 473.59 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 2.10 ± eV
Point Group Symmetry C1
InChIKey REFHRQMTUMSCJM-UHFFFAOYSA-N
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