(2S)-8-Benzyl-2-Hydroperoxy-2-(4-Hydroxybenzyl)-6-(4-Hydroxyphenyl)Imidazo[1,2-A]Pyrazin-3(2H)-One

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Properties Simple | Detailed

Formula C26H22N3O5
IUPAC Name (2s)-8-benzyl-2-hydroperoxy-6-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-5h-imidazo[1,2-a]pyrazin-7-ium-5-id-3-one
Molecular Mass 456.470 g·mol−1
Heat of Formation -74.0 ± 16.7 kJ·mol−1
Dipole Moment 2.29 ± 1.08 D
Volume 525.37 Å 3
Surface Area 447.38 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 1.69 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-hydroperoxy-6-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methyl]-8-(phenylmethyl)-3-imidazo[3,2-a]pyrazinone
  • (2s)-8-(benzyl)-2-hydroperoxy-2-(4-hydroxybenzyl)-6-(4-hydroxyphenyl)imidazo[3,2-a]pyrazin-3-one
  • 8-benzyl-2-hydroperoxy-2-(4-hydroxy-benzyl)-6-(4-hydroxy-phenyl)-2h-imidazo[1,2-a]pyrazin-3-one
  • c2-hydroperoxy-coelenterazine
InChIKey HOSWCJDTHOAORT-SANMLTNESA-N
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