1H-Benzimidazol-2-Yl(4-{[3-(Tetrahydro-2H-Pyran-4-Yl)-2-Pyridinyl]Oxy}Phenyl)Methanone

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Properties Simple | Detailed

Formula C24H21N3O3
IUPAC Name benzimidazol-1-ium-2-yl-[4-[(3-tetrahydropyran-4-yl-2-pyridyl)oxy]phenyl]methanone
Molecular Mass 399.442 g·mol−1
Heat of Formation -35.5 ± 16.7 kJ·mol−1
Dipole Moment 1.56 ± 1.08 D
Volume 463.03 Å 3
Surface Area 413.03 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 1.85 ± eV
Point Group Symmetry C1
InChIKey NQQHFVCQMJVYTB-UHFFFAOYSA-N
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