5-Chloro-3-Ethyl-N-{2-[4-(Piperidin-1-Yl)Phenyl]Ethyl}-1H-Indole-2-Carboxamide

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Properties Simple | Detailed

Formula C24H28ClN3O
IUPAC Name 5-chloro-3-ethyl-n-[2-[4-(1-piperidyl)phenyl]ethyl]indol-1-ium-2-ylium-2-carboxamide
Molecular Mass 409.952 g·mol−1
Heat of Formation -52.4 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 502.01 Å 3
Surface Area 401.87 Å 2
HOMO Energy -8.18 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
InChIKey AHFZDNYNXFMRFQ-UHFFFAOYSA-N
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Elements H C N O Cl