5-Fluoro-2-({[3-(2-Pyrimidinyl)-2-Pyridinyl]Amino}Methyl)Phenol

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Properties Simple | Detailed

Formula C16H13FN4O
IUPAC Name 5-fluoro-2-[[(3-pyrimidin-2-yl-2-pyridyl)amino]methyl]phenol
Molecular Mass 296.299 g·mol−1
Heat of Formation -9.4 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 335.18 Å 3
Surface Area 305.71 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -1.39 ± eV
Point Group Symmetry C1
InChIKey YTVDOVJPKJLMHL-UHFFFAOYSA-N
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