N-[N-(4-Amino-3,5-Dichlorobenzyl)Carbamimidoyl]-3-(4-Methoxyphenyl)-5-Methyl-1,2-Thiazole-4-Carboxamide

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Formula C20H19Cl2N5O2S
IUPAC Name n-[n-[(4-amino-3,5-dichloro-phenyl)methyl]carbamimidoyl]-3-(4-methoxyphenyl)-5-methyl-isothiazole-4-carboxamide
Molecular Mass 464.368 g·mol−1
Heat of Formation -20.4 ± 16.7 kJ·mol−1
Dipole Moment 1.66 ± 1.08 D
Volume 513.71 Å 3
Surface Area 446.02 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C1
InChIKey DPJQBOWFYJTIJB-UHFFFAOYSA-N
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Elements C Cl H O N S