N-(5-{[5-({5-[(3-{[3-(Dimethylamino)Propyl]Amino}-3-Oxopropyl)Carbamoyl]-1-Methyl-1H-Pyrrol-3-Yl}Carbamoyl)-4-Hydroxy-1-Methyl-1H-Pyrrol-3-Yl]Carbamoyl}-1-Methyl-1H-Pyrrol-3-Yl)-1-Methyl-1H-Imidazole-2-Carboxamide

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Properties Simple | Detailed

Formula C31H41N11O6
IUPAC Name n-[5-[[5-[[2-[[3-[3-(dimethylamino)propylamino]-3-oxo-propyl]carbamoyl]-1-methyl-3h-pyrrol-1-ium-3-id-4-yl]carbamoyl]-4-hydroxy-1-methyl-pyrrol-1-ium-3-ylium-3-yl]carbamoyl]-1-methyl-2h-pyrrol-1-ium-2-ylium-3-yl]-3-methyl-4h-imidazol-3-ium-4-ylium-2-carboxamide
Molecular Mass 663.727 g·mol−1
Heat of Formation -603.7 ± 16.7 kJ·mol−1
Dipole Moment 4.46 ± 1.08 D
Volume 775.78 Å 3
Surface Area 697.34 Å 2
HOMO Energy -8.15 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
InChIKey WNWMZSNXDXZKBO-UHFFFAOYSA-N
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