1-(4-{[4,5-Bis(4-Chlorophenyl)-2-(2-Isopropoxy-4-Methoxyphenyl)-4,5-Dihydro-1H-Imidazol-1-Yl]Carbonyl}-1-Piperazinyl)Ethanone

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Properties Simple | Detailed

Formula C32H19Cl2N4O4
IUPAC Name 6,9-dichloro-n-[2-[ethynyl(2-hydroxyethynyl)amino]ethynyl]-2-(4-methoxy-2-methyl-benzofuran-7-yl)-11bh-phenanthro[9,10-d]imidazol-3-ium-1-carboxamide
Molecular Mass 594.424 g·mol−1
Heat of Formation 4314.4 ± 16.7 kJ·mol−1
Dipole Moment 29.86 ± 1.08 D
Volume 602.26 Å 3
Surface Area 489.22 Å 2
HOMO Energy -7.70 ± 0.55 eV
LUMO Energy -3.22 ± eV
Point Group Symmetry C1
InChIKey IYDMGGPKSVWQRT-KYJUHHDHSA-N
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Elements C N O Cl