3-[2-[(Z)-[3-(2-Carboxyethyl)-4-Methyl-5-[(Z)-(3-Methyl-5-Oxo-4-Vinyl-Pyrrol-2-Ylidene)Methyl]Pyrrol-2-Ylidene]Methyl]-5-[(Z)-[(3Z,4R)-3-Ethylidene-4-Methyl-5-Oxo-Pyrrolidin-2-Ylidene]Methyl]-4-Methyl-1H-Pyrrol-3-Yl]Propanoic Acid

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Properties Simple | Detailed

Formula C33H20N4O6+
IUPAC Name 3-[2-[(z)-[3-(2-carboxyethyl)-4-methyl-5-[(z)-(3-methyl-5-oxo-4-vinyl-pyrrol-2-ylidene)methyl]pyrrol-2-ylidene]methyl]-5-[(z)-[(3e)-3-ethylidene-4-methyl-5-oxo-pyrrolidin-2-ylidene]methyl]-4-methyl-1h-pyrrol-3-yl]propanoic acid
Molecular Mass 568.535 g·mol−1
Heat of Formation 3172.2 ± 16.7 kJ·mol−1
Dipole Moment 10.49 ± 1.08 D
Volume 664.02 Å 3
Surface Area 578.17 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -2.33 ± eV
Point Group Symmetry C1
InChIKey DKMLMZVDTGOEGU-ZZEPTHGGSA-O
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