2,6-Diamino-7-(3H-Thiophen-1-Ium-3-Id-4-Ylmethyl)-1H-Pyrrolo[3,2-D]Pyrimidin-3-Ium-4-One

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Formula C11H11N5OS
IUPAC Name 2,6-diamino-7-(3h-thiophen-1-ium-3-id-4-ylmethyl)-1h-pyrrolo[3,2-d]pyrimidin-3-ium-4-one
Molecular Mass 261.303 g·mol−1
Heat of Formation 158.3 ± 16.7 kJ·mol−1
Dipole Moment 7.44 ± 1.08 D
Volume 289.95 Å 3
Surface Area 259.12 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
InChIKey TUTXDIHSACBSJS-UHFFFAOYSA-O
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