(3As,7Ar)-7A-[3-(5-Pyrimidinyl)Phenyl]-3A,6,7,7A-Tetrahydro-4H-Pyrano[4,3-D][1,3]Oxazol-2-Amine

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Formula C16H16N4O2
IUPAC Name (3as,7ar)-7a-(3-pyrimidin-5-ylphenyl)-3a,4,6,7-tetrahydropyrano[4,3-d]oxazol-2-amine
Molecular Mass 296.324 g·mol−1
Heat of Formation 21.9 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 338.9 Å 3
Surface Area 299.42 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -1.36 ± eV
Point Group Symmetry C1
InChIKey QBOAOWFKBWILHE-GDBMZVCRSA-N
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