N-{[(1R,2R)-2-(3-Fluorophenyl)Cyclopropyl]Methyl}-2-[2-(1H-Imidazol-1-Yl)-4-Pyrimidinyl]Ethanamine

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Properties Simple | Detailed

Formula C19H20FN5
IUPAC Name n-[[(1r,2r)-2-(3-fluorophenyl)cyclopropyl]methyl]-2-[2-(2h-imidazol-1-ium-2-ylium-1-yl)pyrimidin-4-yl]ethanamine
Molecular Mass 337.394 g·mol−1
Heat of Formation 302.7 ± 16.7 kJ·mol−1
Dipole Moment 3.68 ± 1.08 D
Volume 413.1 Å 3
Surface Area 382.14 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -1.48 ± eV
Point Group Symmetry C1
InChIKey GLFSJKKKONEYJI-YJBOKZPZSA-N
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Elements H C F N