N-[4-(Aminomethyl)Benzyl]-4-Oxo-1,4-Dihydrothieno[2,3-D]Pyrimidine-5-Carboxamide

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Formula C15H15N4O2S
IUPAC Name n-[[4-(aminomethyl)phenyl]methyl]-4-oxo-3h-thieno[2,3-d]pyrimidin-1-ium-4a-ide-5-carboxamide
Molecular Mass 315.370 g·mol−1
Heat of Formation -69.9 ± 16.7 kJ·mol−1
Dipole Moment 5.30 ± 1.08 D
Volume 353.57 Å 3
Surface Area 316.85 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 1.48 ± eV
Point Group Symmetry C1
InChIKey ZOJIHHOGTNVURO-UHFFFAOYSA-O
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