N-[(2Z)-3-Allyl-5-Nitro-1,3-Thiazol-2(3H)-Ylidene]-2,2-Dimethylpropanamide

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Properties Simple | Detailed

Formula C11H15N3O3S
IUPAC Name (nz)-n-(3-allyl-5-nitro-thiazole-1,3-diium-2-ylidene)-2,2-dimethyl-propanamide
Molecular Mass 269.320 g·mol−1
Heat of Formation -60.1 ± 16.7 kJ·mol−1
Dipole Moment 7.44 ± 1.08 D
Volume 321.68 Å 3
Surface Area 281.99 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 1.54 ± eV
Point Group Symmetry C1
InChIKey SPVZIILAYYBEDM-BENRWUELSA-N
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