N-(2-Biphenylyl)-7-Nitro-2,1,3-Benzoxadiazol-4-Amine

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Properties Simple | Detailed

Formula C18H12N4O3
IUPAC Name 4-nitro-n-(2-phenylphenyl)-2,1,3-benzoxadiazol-7-amine
Molecular Mass 332.313 g·mol−1
Heat of Formation 2661.6 ± 16.7 kJ·mol−1
Dipole Moment 7.56 ± 1.08 D
Volume 261.98 Å 3
Surface Area 212.95 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -3.44 ± eV
Point Group Symmetry C1
Synonyms
  • (7-nitrobenzofurazan-4-yl)-(2-phenylphenyl)amine
  • 4-nitro-n-(2-phenylphenyl)-2,1,3-benzoxadiazol-7-amine
  • oprea1_158245
  • zinc03879010
InChIKey KMJPYSQOCBYMCF-UHFFFAOYSA-N
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