2,4-Dichloro-6-[(4,5-Dichloro-3-Nitro-1H-Pyrrol-2-Yl)Methyl]Phenol

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Formula C11H6Cl4N2O3
IUPAC Name 2,4-dichloro-6-[(4,5-dichloro-3-nitro-pyrrol-1-ium-2-ylium-2-yl)methyl]phenol
Molecular Mass 355.989 g·mol−1
Heat of Formation -156.5 ± 16.7 kJ·mol−1
Dipole Moment 5.49 ± 1.08 D
Volume 335.19 Å 3
Surface Area 299.06 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy 1.67 ± eV
Point Group Symmetry C1
Synonyms
  • phenol, 2,4-dichloro-6-((4,5-dichloro-3-nitro-1h-pyrrol-2-yl)methyl)-
  • phenol, 2,4-dichloro-6-((4,5-dichloro-3-nitropyrrol-2-yl)methyl)-
  • pyrrolomycin b
  • sf-2080b
CAS Number(s)
  • 79763-00-1
InChIKey ZIOBWQJYKHDNKP-UHFFFAOYSA-N
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Elements H C N O Cl