1-Methyl-4-({4-[({4'-[(1-Methyl-4-Pyridiniumyl)Amino]-4-Biphenylyl}Carbonyl)Amino]Phenyl}Amino)Pyridinium

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Properties Simple | Detailed

Formula C31H29N5O++
IUPAC Name n,4-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide
Molecular Mass 487.595 g·mol−1
Heat of Formation 1077755.4 ± 16.7 kJ·mol−1
Dipole Moment 4516.42 ± 1.08 D
Volume 586.65 Å 3
Surface Area 529.57 Å 2
HOMO Energy -0.51 ± 0.55 eV
LUMO Energy 1.95 ± eV
Point Group Symmetry C1
Synonyms
  • n,4-bis[4-[(1-methyl-4-pyridin-1-iumyl)amino]phenyl]benzamide
  • n,4-bis[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide
  • pyridinium, 1-methyl-4-((4-(((4'-((1-methylpyridinium-4-yl)amino)(1,1'-biphenyl)-4-yl)carbonyl)amino)phenyl)amino)-
  • sn 6570
CAS Number(s)
  • 18355-40-3
InChIKey XHWGMWDUNASTLL-UHFFFAOYSA-P
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