(2-Amino-5-Bromophenyl)[(3R,5S)-3,5-Dimethyl-1-Piperidinyl]Methanone

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Properties Simple | Detailed

Formula C14H19BrN2O
IUPAC Name (2-amino-5-bromo-phenyl)-[(3s,5r)-3,5-dimethyl-1-piperidyl]methanone
Molecular Mass 311.217 g·mol−1
Heat of Formation -185.3 ± 16.7 kJ·mol−1
Dipole Moment 3.49 ± 1.08 D
Volume 333.94 Å 3
Surface Area 289.4 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
InChIKey IUPOWBZLJSPZFT-AOOOYVTPSA-N
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Elements H C O Br N