(2E)-2-(Isopropylidenehydrazono)-3-Methyl-2,3-Dihydro-1,3-Benzothiazole

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Properties Simple | Detailed

Formula C11H13N3S
IUPAC Name n-(isopropylideneamino)-3-methyl-1,3-benzothiazol-2-imine
Molecular Mass 219.306 g·mol−1
Heat of Formation 245.2 ± 16.7 kJ·mol−1
Dipole Moment 2.15 ± 1.08 D
Volume 264.14 Å 3
Surface Area 253.14 Å 2
HOMO Energy -7.93 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry Cs
Synonyms
  • (e)-(isopropylideneamino)-(3-methyl-1,3-benzothiazol-2-ylidene)amine
  • 2(3h)-benzothiazolone, 3-methyl-, (1-methylethylidene)hydrazone
  • 3-methyl-2-benzothiazolinone acetone azine
  • 3-methyl-n-(propan-2-ylideneamino)-1,3-benzothiazol-2-imine
  • mbtaa
  • n-(isopropylideneamino)-3-methyl-1,3-benzothiazol-2-imine
CAS Number(s)
  • 53338-83-3
InChIKey RPVXHIUJWZMKNB-ACCUITESSA-N
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