3-[2-[[3-(2-Carboxyethyl)-4-Methyl-5-[(4-Methyl-5-Oxo-3-Vinyl-Pyrrol-2-Yl)Methylene]Pyrrol-2-Ylidene]Methyl]-4-Methyl-5-[(3-Methyl-5-Oxo-4-Vinyl-1,2-Dihydropyrrol-2-Yl)Methyl]-1H-Pyrrol-3-Yl]Propanoic Acid

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Properties Simple | Detailed

Formula C33H36N4O6
IUPAC Name 3-[2-[(e)-[(5z)-3-(2-carboxyethyl)-4-methyl-5-[(4-methyl-5-oxo-3-vinyl-pyrrol-2-yl)methylene]pyrrol-2-ylidene]methyl]-4-methyl-5-[[(2s)-3-methyl-5-oxo-4-vinyl-1,2-dihydropyrrol-2-yl]methyl]-1h-pyrrol-3-yl]propanoic acid
Molecular Mass 584.662 g·mol−1
Heat of Formation 2837.8 ± 16.7 kJ·mol−1
Dipole Moment 4.45 ± 1.08 D
Volume 598.15 Å 3
Surface Area 515.81 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -3.44 ± eV
Point Group Symmetry C1
InChIKey CGSPNIOREWHDGG-XVUGFWEHSA-N
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