Pyrimidine, 2-((2,4-Dinitrophenyl)Thio)-

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Properties Simple | Detailed

Formula C10H6N4O4S
IUPAC Name 2-(2,4-dinitrophenyl)sulfanylpyrimidine
Molecular Mass 278.244 g·mol−1
Heat of Formation 1933.7 ± 16.7 kJ·mol−1
Dipole Moment 14.51 ± 1.08 D
Volume 266.79 Å 3
Surface Area 251.6 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy -2.45 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4-dinitropyrimidinyl-2-thiophenol
  • 2-(2,4-dinitrophenyl)sulfanylpyrimidine
  • 2-[(2,4-dinitrophenyl)thio]pyrimidine
  • jcc 216
  • mls000757063
  • nsc302584
  • pyrimidine, 2-((2,4-dinitrophenyl)thio)-
  • smr000449836
  • zinc01567155
CAS Number(s)
  • 66474-53-1
InChIKey UDWLPPBHVNQRBL-UHFFFAOYSA-N
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