4-[(6,7-Dimethoxy-2,4-Dihydroindeno[1,2-C]Pyrazol-3-Yl)Ethynyl]-2-Methoxyphenol

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Formula C21H18N2O4
IUPAC Name 4-[2-(6,7-dimethoxy-4h-indeno[1,2-c]pyrazol-2-ium-3a-id-3-yl)ethynyl]-2-methoxy-phenol
Molecular Mass 362.379 g·mol−1
Heat of Formation 21.2 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 415.92 Å 3
Surface Area 389.17 Å 2
HOMO Energy -8.14 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
InChIKey MPWLZTAOZDBWMH-UHFFFAOYSA-N
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