3,3',3''-(3,8,12,18-Tetramethyl-7-Vinyl-6,10,14,15,20,24-Hexahydro-1H,5H-Porphine-2,13,17-Triyl)Tripropanoic Acid

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Formula C35H42N4O6
IUPAC Name 3-[7,18-bis(2-carboxyethyl)-3,8,13,17-tetramethyl-12-vinyl-5,6,10,11,15,19,20,21-octahydroporphyrin-23-ium-2,3,4-triid-2-yl]propanoic acid
Molecular Mass 614.731 g·mol−1
Heat of Formation 4306.4 ± 16.7 kJ·mol−1
Dipole Moment 4.23 ± 1.08 D
Volume 663.85 Å 3
Surface Area 544.0 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy -2.34 ± eV
Point Group Symmetry C1
InChIKey QTGZHJUSEYHULR-CHQNGUEUSA-N
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