N-(5-Nitrothiazol-3-Ium-5-Id-2-Yl)Thiophene-2-Carboxamide

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Properties Simple | Detailed

Formula C8H6N3O3S2
IUPAC Name n-(5-nitrothiazol-3-ium-5-id-2-yl)thiophene-2-carboxamide
Molecular Mass 256.281 g·mol−1
Heat of Formation 137.5 ± 16.7 kJ·mol−1
Dipole Moment 9.08 ± 1.08 D
Volume 257.61 Å 3
Surface Area 247.68 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy 1.16 ± eV
Point Group Symmetry C1
InChIKey JJCIQAGDLKQOLA-UHFFFAOYSA-N
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