2,6-Diamino-5-(Benzylamino)-4(1H)-Pyrimidinone

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Formula C11H13N5O
IUPAC Name 2,6-diamino-5-(benzylamino)-1h-pyrimidin-3-ium-4-one
Molecular Mass 231.254 g·mol−1
Heat of Formation 114.7 ± 16.7 kJ·mol−1
Dipole Moment 6.45 ± 1.08 D
Volume 269.42 Å 3
Surface Area 259.09 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
InChIKey CACPSDMCHOGVPW-UHFFFAOYSA-O
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