4-Amino-5-Chloro-2-Methoxy-N-(8-Methyl-8-Azabicyclo[3.2.1]Oct-3-Yl)Benzamide

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Properties Simple | Detailed

Formula C16H22ClN3O2
IUPAC Name 4-amino-5-chloro-2-methoxy-n-[(1r,5s)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]benzamide
Molecular Mass 323.818 g·mol−1
Heat of Formation -318.2 ± 16.7 kJ·mol−1
Dipole Moment 2.66 ± 1.08 D
Volume 385.87 Å 3
Surface Area 332.68 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
InChIKey HTMNINCXKXABOI-RTCCRHLQSA-N
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Elements H C N O Cl