1-(1H-Imidazol-5-Ylmethyl)-2,3,4,9-Tetrahydro-1H-β-Carboline

Molecule SVG Image

Properties Simple | Detailed

Formula C15H16N4
IUPAC Name (1r)-1-(imidazol-3-ium-4-ylium-4-ylmethyl)-1,2,3,4-tetrahydropyrido[3,4-b]indol-9-ium-9a-ylium
Molecular Mass 252.314 g·mol−1
Heat of Formation 304.1 ± 16.7 kJ·mol−1
Dipole Moment 5.13 ± 1.08 D
Volume 304.45 Å 3
Surface Area 267.7 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy 0.03 ± eV
Point Group Symmetry C1
InChIKey SLFMYESZZPZJHF-CQSZACIVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N