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Properties Simple | Detailed

Formula C27H24N5O4+
IUPAC Name n-[4-oxo-2-(1h-tetrazol-5-yl)chromen-1-ium-8-yl]-4-(4-phenylbutoxy)benzamide
Molecular Mass 482.511 g·mol−1
Heat of Formation 1334.7 ± 16.7 kJ·mol−1
Dipole Moment 36.39 ± 1.08 D
Volume 550.33 Å 3
Surface Area 489.11 Å 2
HOMO Energy -6.34 ± 0.55 eV
LUMO Energy -5.46 ± eV
Point Group Symmetry C1
Synonyms
  • n-[4-keto-2-(2h-tetrazol-5-yl)chromen-8-yl]-4-(4-phenylbutoxy)benzamide
  • n-[4-oxo-2-(2h-1,2,3,4-tetrazol-5-yl)chromen-8-yl]-4-(4-phenylbutoxy)benzamide
  • n-[4-oxo-2-(2h-tetrazol-5-yl)-8-chromenyl]-4-(4-phenylbutoxy)benzamide
InChIKey NBQKINXMPLXUET-UHFFFAOYSA-N
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