Nizofenone

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Properties Simple | Detailed

Formula C21H21ClN4O3
IUPAC Name (2-chlorophenyl)-[2-[2-(diethylaminomethyl)imidazol-1-ium-2-ylium-1-yl]-5-nitro-phenyl]methanone
Molecular Mass 412.869 g·mol−1
Heat of Formation 79.5 ± 16.7 kJ·mol−1
Dipole Moment 5.64 ± 1.08 D
Volume 471.5 Å 3
Surface Area 354.43 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy 1.38 ± eV
Point Group Symmetry C1
Synonyms
  • (2-chlorophenyl)-[2-[2-(diethylaminomethyl)-1-imidazolyl]-5-nitrophenyl]methanone
  • (2-chlorophenyl)-[2-[2-(diethylaminomethyl)imidazol-1-yl]-5-nitro-phenyl]methanone
  • (2-chlorophenyl)-[2-[2-(diethylaminomethyl)imidazol-1-yl]-5-nitrophenyl]methanone
  • 2'-chlor-2-(2-(diethylaminomethyl)-1-imidazolyl)-5-nitrobenzophenon
  • 2'-chloro-2-(2-((diethylamino)methyl)imidazol-1-yl)-5-nitrobenzophenone
  • oprea1_229738
  • y 9179
InChIKey WZGBZLHGOVJDET-UHFFFAOYSA-N
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