3-(4'-Hydroxy-4-Biphenylyl)-N-(Trans-4-Hydroxycyclohexyl)-1,4-Dihydroindeno[1,2-C]Pyrazole-6-Carboxamide

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Formula C29H27N3O3
IUPAC Name n-(4-hydroxycyclohexyl)-3-[4-(4-hydroxyphenyl)phenyl]-4h-indeno[1,2-c]pyrazol-1-ium-3a-ide-6-carboxamide
Molecular Mass 465.543 g·mol−1
Heat of Formation -86.5 ± 16.7 kJ·mol−1
Dipole Moment 4.10 ± 1.08 D
Volume 555.4 Å 3
Surface Area 488.06 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
InChIKey VKPCXCHYSBVEMW-HCGLCNNCSA-N
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