2-Methyl-4-Benzylaminopyrrolo[2,3D]Pyrimidine

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Properties Simple | Detailed

Formula C14H15N4
IUPAC Name n-benzyl-2-methyl-7h-pyrrolo[2,3-d]pyrimidine-1,3-diium-4a-id-4-amine
Molecular Mass 239.296 g·mol−1
Heat of Formation 297.5 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 288.88 Å 3
Surface Area 277.53 Å 2
HOMO Energy -8.31 ± 0.55 eV
LUMO Energy 2.82 ± eV
Point Group Symmetry C1
InChIKey HPZHFGBKCGWNGN-UHFFFAOYSA-O
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Elements H C N