2-Imino-5-[5-(2-Nitro-Phenyl)-Furan-2-Ylmethylene]-Thiazolidin-4-One

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Properties Simple | Detailed

Formula C14H9N3O4S
IUPAC Name (5e)-2-amino-5-[[5-(2-nitrophenyl)-2-furyl]methylene]thiazol-4-one
Molecular Mass 315.304 g·mol−1
Heat of Formation 1835.7 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 311.19 Å 3
Surface Area 280.02 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -3.34 ± eV
Point Group Symmetry C1
Synonyms
  • (5e)-2-amino-5-[[5-(2-nitrophenyl)-2-furyl]methylene]-4-thiazolone
  • (5e)-2-amino-5-[[5-(2-nitrophenyl)-2-furyl]methylene]thiazol-4-one
  • (5e)-2-amino-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-4-one
  • 2-amino-5-[[5-(2-nitrophenyl)-2-furyl]methylene]-4-thiazolone
  • 2-amino-5-[[5-(2-nitrophenyl)-2-furyl]methylene]thiazol-4-one
  • 2-amino-5-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-4-one
  • a0889/0041719
  • zinc03898548
InChIKey CZZAPCPWFCGOCC-KPKJPENVSA-N
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