4'-(Cyclopropylmethyl)-N~2~-(4-Pyridinyl)-4,5'-Bipyrimidine-2,2'-Diamine

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Properties Simple | Detailed

Formula C17H17N7
IUPAC Name 4-(cyclopropylmethyl)-5-[2-(4-pyridylamino)pyrimidin-4-yl]pyrimidin-2-amine
Molecular Mass 319.364 g·mol−1
Heat of Formation 509.2 ± 16.7 kJ·mol−1
Dipole Moment 4.71 ± 1.08 D
Volume 380.26 Å 3
Surface Area 340.71 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 1.20 ± eV
Point Group Symmetry C1
InChIKey XXSDLQLNIVFIJI-UHFFFAOYSA-N
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Elements H C N