1-(3-{(2S,5S)-5-[(6-Bromo-1H-Indol-3-Yl)Methyl]-3,6-Dioxo-2-Piperazinyl}Propyl)Guanidine

Molecule SVG Image

Properties Simple | Detailed

Formula C17H21BrN6O2
IUPAC Name 2-[3-[(2s,5s)-5-[(6-bromo-2h-indol-1-ium-2-ylium-3-yl)methyl]-3,6-dioxo-piperazin-2-yl]propyl]guanidine
Molecular Mass 421.292 g·mol−1
Heat of Formation -137.7 ± 16.7 kJ·mol−1
Dipole Moment 3.01 ± 1.08 D
Volume 438.46 Å 3
Surface Area 395.98 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
InChIKey HVWYYWIRLPBRTO-JSGCOSHPSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O Br N