[2-(Allylamino)-4-Amino-1,3-Thiazol-5-Yl](3-Pyridinyl)Methanone

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Properties Simple | Detailed

Formula C12H12N4OS
IUPAC Name [2-(allylamino)-4-amino-thiazol-5-yl]-(3-pyridyl)methanone
Molecular Mass 260.315 g·mol−1
Heat of Formation 167.4 ± 16.7 kJ·mol−1
Dipole Moment 7.10 ± 1.08 D
Volume 298.92 Å 3
Surface Area 282.66 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
InChIKey QNNXJIYSLIKTDV-UHFFFAOYSA-N
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