(2-Iodophenyl)(1-{[(2S)-1-Methyl-2-Piperidinyl]Methyl}-1H-Indol-3-Yl)Methanone

Molecule SVG Image

Properties Simple | Detailed

Formula C22H23IN2O
IUPAC Name (2-iodophenyl)-[1-[[(1r,2s)-1-methyl-2-piperidyl]methyl]indol-1-ium-3-yl]methanone
Molecular Mass 458.335 g·mol−1
Heat of Formation 167.4 ± 16.7 kJ·mol−1
Dipole Moment 5.58 ± 1.08 D
Volume 460.52 Å 3
Surface Area 373.04 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (2-iodophenyl)-[1-[[(2s)-1-methyl-2-piperidinyl]methyl]-3-indolyl]methanone
  • (2-iodophenyl)-[1-[[(2s)-1-methyl-2-piperidyl]methyl]indol-3-yl]methanone
  • (2-iodophenyl)-[1-[[(2s)-1-methylpiperidin-2-yl]methyl]indol-3-yl]methanone
InChIKey KSLCYQTUSSEGPT-INIZCTEOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements I H C O N