Zyzzyanone D

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Properties Simple | Detailed

Formula C20H17N3O4
IUPAC Name n-[2-[5-(4-hydroxyphenyl)-4,8-dioxo-pyrrolo[3,2-f]indol-7-ium-7a-ylium-3-yl]ethyl]-n-methyl-formamide
Molecular Mass 363.367 g·mol−1
Heat of Formation -318.5 ± 16.7 kJ·mol−1
Dipole Moment 6.25 ± 1.08 D
Volume 414.68 Å 3
Surface Area 360.53 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
Synonyms
  • n-[2-[3-(4-hydroxyphenyl)-4,8-diketo-1,7-dihydropyrrolo[4,5-f]indol-5-yl]ethyl]-n-methyl-formamide
  • n-[2-[3-(4-hydroxyphenyl)-4,8-dioxo-1,7-dihydropyrrolo[4,5-f]indol-5-yl]ethyl]-n-methyl-formamide
  • n-[2-[3-(4-hydroxyphenyl)-4,8-dioxo-1,7-dihydropyrrolo[4,5-f]indol-5-yl]ethyl]-n-methyl-methanamide
  • n-[2-[3-(4-hydroxyphenyl)-4,8-dioxo-1,7-dihydropyrrolo[4,5-f]indol-5-yl]ethyl]-n-methylformamide
InChIKey OBNMCBPRQYXKOU-UHFFFAOYSA-N
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