1-(3-Methoxy-1,2-Benzothiazol-7-Yl)-3-Phenylurea

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Properties Simple | Detailed

Formula C15H13N3O2S
IUPAC Name 1-(3-methoxy-1,2-benzothiazol-7-yl)-3-phenyl-urea
Molecular Mass 299.348 g·mol−1
Heat of Formation -6.6 ± 16.7 kJ·mol−1
Dipole Moment 1.14 ± 1.08 D
Volume 330.07 Å 3
Surface Area 311.97 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 104121-66-6
InChIKey VBXFEJLFBBAXQR-UHFFFAOYSA-N
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