1-[5-(Hydroxymethyl)-2-Furyl]-9H-β-Carboline-3-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C17H13N3O3
IUPAC Name 1-[5-(hydroxymethyl)-2-furyl]pyrido[3,4-b]indol-9-ium-3-carboxamide
Molecular Mass 307.303 g·mol−1
Heat of Formation -114.6 ± 16.7 kJ·mol−1
Dipole Moment 6.87 ± 1.08 D
Volume 342.87 Å 3
Surface Area 318.41 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -1.06 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(5-methylol-2-furyl)-9h-$b-carboline-3-carboxamide
  • 1-[5-(hydroxymethyl)-2-furyl]-9h-pyrido[5,4-b]indole-3-carboxamide
  • 1-[5-(hydroxymethyl)furan-2-yl]-9h-pyrido[5,4-b]indole-3-carboxamide
InChIKey VXKPNUDKWLHUBX-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N