2-{(Z)-[(5Z)-3-Methoxy-5-(2H-Pyrrol-2-Ylidene)-1,5-Dihydro-2H-Pyrrol-2-Ylidene]Methyl}-5-Undecyl-1H-Pyrrole

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Properties Simple | Detailed

Formula C25H35N3O
IUPAC Name (2z,5z)-3-methoxy-5-pyrrol-2-ylidene-2-[(5-undecylpyrrol-1-ium-5-ylium-2-yl)methylene]pyrrole
Molecular Mass 393.565 g·mol−1
Heat of Formation 102.4 ± 16.7 kJ·mol−1
Dipole Moment 7.33 ± 1.08 D
Volume 530.5 Å 3
Surface Area 495.63 Å 2
HOMO Energy -7.84 ± 0.55 eV
LUMO Energy -1.51 ± eV
Point Group Symmetry C1
Synonyms
  • (2z,5z)-3-methoxy-5-(2-pyrrolylidene)-2-[(5-undecyl-1h-pyrrol-2-yl)methylene]pyrrole
  • (2z,5z)-3-methoxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1h-pyrrol-2-yl)methylene]-3-pyrroline
  • (2z,5z)-3-methoxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1h-pyrrol-2-yl)methylene]pyrrole
  • (2z,5z)-3-methoxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1h-pyrrol-2-yl)methylidene]pyrrole
  • 1h-pyrrole, 2-((3-methoxy-5-(1h-pyrrol-2-yl)-2h-pyrrol-2-ylidene)methyl)-5-undecyl-
InChIKey ISFCPXILUVJVOC-KYGJEJSHSA-N
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