4-(2,4-Dimethylthiazol-3-Ium-5-Id-5-Yl)-N-(3-Nitrophenyl)-5H-Pyrimidine-1,3-Diium-5-Id-2-Amine

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Formula C15H13N5O2S
IUPAC Name 4-(2,4-dimethylthiazol-3-ium-5-id-5-yl)-n-(3-nitrophenyl)-5h-pyrimidine-1,3-diium-5-id-2-amine
Molecular Mass 327.361 g·mol−1
Heat of Formation 337.7 ± 16.7 kJ·mol−1
Dipole Moment 7.28 ± 1.08 D
Volume 359.47 Å 3
Surface Area 333.04 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 1.60 ± eV
Point Group Symmetry C1
InChIKey PBEBICDNDMORRQ-UHFFFAOYSA-N
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