(4E,4'E)-2,2'-[(4-Hydroxyphenyl)Methylene]Bis(4-{[(5-Methyl-1H-Tetrazol-1-Yl)Amino]Methylene}-2,5-Cyclohexadien-1-One)

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Properties Simple | Detailed

Formula C25H22N10O3
IUPAC Name (4e)-2-[(4-hydroxyphenyl)-[(3e)-3-[[(5-methyltetrazol-1-yl)amino]methylidene]-6-oxocyclohexa-1,4-dien-1-yl]methyl]-4-[[(5-methyltetrazol-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one
Molecular Mass 510.507 g·mol−1
Heat of Formation 788.5 ± 16.7 kJ·mol−1
Dipole Moment 4.04 ± 1.08 D
Volume 587.35 Å 3
Surface Area 509.83 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -1.97 ± eV
Point Group Symmetry C1
Synonyms
  • phenol, 2,2'-[(4-hydroxyphenyl)methylene]bis[4-[(e)-[(5-methyl-1h-tetrazol-1-yl)imino]methyl]-
InChIKey PBLRUGKPXXSWKC-HBKJEHTGSA-N
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