Marinopyrrole A

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Properties Simple | Detailed

Formula C22H12Cl4N2O4
IUPAC Name [4,5-dichloro-1-[4,5-dichloro-2-(2-hydroxybenzoyl)pyrrol-1-ium-2-ylium-3-yl]pyrrol-1-ium-2-ylium-2-yl]-(2-hydroxyphenyl)methanone
Molecular Mass 510.154 g·mol−1
Heat of Formation -335.9 ± 16.7 kJ·mol−1
Dipole Moment 9.04 ± 1.08 D
Volume 507.18 Å 3
Surface Area 385.33 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 1.64 ± eV
Point Group Symmetry C1
Synonyms
  • [4,5-dichloro-3-[2,3-dichloro-5-(2-hydroxybenzoyl)pyrrol-1-yl]-1h-pyrrol-2-yl]-(2-hydroxyphenyl)methanone
  • [4,5-dichloro-3-[2,3-dichloro-5-(2-hydroxyphenyl)carbonyl-pyrrol-1-yl]-1h-pyrrol-2-yl]-(2-hydroxyphenyl)methanone
  • [4,5-dichloro-3-[2,3-dichloro-5-[(2-hydroxyphenyl)-oxomethyl]-1-pyrrolyl]-1h-pyrrol-2-yl]-(2-hydroxyphenyl)methanone
InChIKey QYPJBTMRYKRTFG-UHFFFAOYSA-N
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Elements H C N O Cl