6-(3-Chloro-4-Fluorobenzyl)-4-Hydroxy-2-Isopropyl-N,N-Dimethyl-3,5-Dioxo-2,3,5,6,7,8-Hexahydro-2,6-Naphthyridine-1-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C21H23ClFN3O4+
IUPAC Name 6-[(3-chloro-4-fluoro-phenyl)methyl]-4-hydroxy-2-isopropyl-n,n-dimethyl-3,5-dioxo-7,8-dihydro-2,6-naphthyridin-2-ium-4-ylium-1-carboxamide
Molecular Mass 435.876 g·mol−1
Heat of Formation -783.1 ± 16.7 kJ·mol−1
Dipole Moment 7.27 ± 1.08 D
Volume 492.08 Å 3
Surface Area 402.25 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.88 ± eV
Point Group Symmetry C1
InChIKey HFCJYZIWLQSWGP-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H F O N