1-(8-Chloro-1,3,4,5-Tetrahydro-2H-Pyrido[4,3-B]Indol-2-Yl)Ethanone

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Properties Simple | Detailed

Formula C13H13ClN2O
IUPAC Name 1-(8-chloro-3,4-dihydro-1h-pyrido[4,3-b]indol-5-ium-2-yl)ethanone
Molecular Mass 248.708 g·mol−1
Heat of Formation -75.2 ± 16.7 kJ·mol−1
Dipole Moment 7.83 ± 1.08 D
Volume 283.52 Å 3
Surface Area 259.39 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
InChIKey SHHTZAIHGFNPTK-UHFFFAOYSA-N
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Elements H C Cl O N