4-{[4-Amino-6-(2,6-Dichlorophenoxy)-1,3,5-Triazin-2-Yl]Amino}Benzonitrile

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Properties Simple | Detailed

Formula C16H10Cl2N6O
IUPAC Name 4-[[4-amino-6-(2,6-dichlorophenoxy)-1,3,5-triazin-2-yl]amino]benzonitrile
Molecular Mass 373.196 g·mol−1
Heat of Formation 311.8 ± 16.7 kJ·mol−1
Dipole Moment 6.12 ± 1.08 D
Volume 390.86 Å 3
Surface Area 355.69 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy 1.92 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[4-amino-6-(2,6-dichloro-phenoxy)-[1,3,5]triazin-2-ylamino]-benzonitrile
  • 4-[[4-amino-6-(2,6-dichlorophenoxy)-s-triazin-2-yl]amino]benzonitrile
  • 4-{[3-amino-5-(2,6-dichlorophenoxy)1,3,5-triazin-2-yl]amino}benzenecarbonitrile
  • adb
InChIKey NFNNMVVXXITVGD-UHFFFAOYSA-N
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Elements H C N O Cl