7-(3-{[(4-Azido-3-Iodophenyl)Sulfonyl]Amino}-6,6-Dimethylbicyclo[3.1.1]Hept-2-Yl)-5-Heptenoic Acid

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Formula C22H30IN4O4S
IUPAC Name (e)-7-[(1r,2s,3s,5s)-3-[(4-azido-3-iodo-phenyl)sulfonylamino]-6,6-dimethyl-norpinan-2-yl]hept-5-enoic acid
Molecular Mass 573.467 g·mol−1
Heat of Formation -266.5 ± 16.7 kJ·mol−1
Dipole Moment 6.47 ± 1.08 D
Volume 579.88 Å 3
Surface Area 438.74 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 1.60 ± eV
Point Group Symmetry C1
InChIKey KYWKCULJQFXKEZ-INFAMTPPSA-N
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