(Z)-1-(2-{[6-(2-Chlorophenoxy)-5-Fluoro-4-Pyrimidinyl]Oxy}Phenyl)-1-(5,6-Dihydro-1,4,2-Dioxazin-3-Yl)-N-Methoxymethanimine

Molecule SVG Image

Properties Simple | Detailed

Formula C21H16ClFN4O5
IUPAC Name (z)-1-[2-[6-(2-chlorophenoxy)-5-fluoropyrimidin-4-yl]oxyphenyl]-1-(5,6-dihydro-1,4,2-dioxazin-3-yl)-n-methoxymethanimine
Molecular Mass 458.827 g·mol−1
Heat of Formation 2470.7 ± 16.7 kJ·mol−1
Dipole Moment 1.99 ± 1.08 D
Volume 468.23 Å 3
Surface Area 380.72 Å 2
HOMO Energy -10.25 ± 0.55 eV
LUMO Energy -2.15 ± eV
Point Group Symmetry C1
Synonyms
  • (
  • )
  • ,
  • -
  • 1
  • 2
  • 3
  • 4
  • 5
  • 6
  • [
  • ]
  • a
  • c
  • d
  • e
  • f
  • h
  • i
  • l
  • m
  • n
  • o
  • p
  • r
  • t
  • u
  • x
  • y
  • z
InChIKey UFEODZBUAFNAEU-ITYLOYPMSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements N F C O Cl