1-Deoxy-1-(2,4,8-Trioxo-1,3,4,8-Tetrahydropyrimido[4,5-B]Quinolin-10(2H)-Yl)Pentitol

Molecule SVG Image

Properties Simple | Detailed

Formula C16H26N3O7+
IUPAC Name 10-[(2s,3s,4r)-2,3,4,5-tetrahydroxypentyl]-5,6,7,9-tetrahydro-1h-pyrimido[4,5-b]quinoline-4a,5,5a,6,7,9,9a,10a-octaide-2,4,8-trione
Molecular Mass 372.394 g·mol−1
Heat of Formation -1083.8 ± 16.7 kJ·mol−1
Dipole Moment 4.41 ± 1.08 D
Volume 390.49 Å 3
Surface Area 335.89 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.39 ± eV
Point Group Symmetry C1
InChIKey HJMIIBXYFPJZBP-XQQFMLRXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N