(2S)-2-Chloro-3-(3-Chloro-2-Methylphenyl)Propanenitrile

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Properties Simple | Detailed

Formula C10H9Cl2N
IUPAC Name (2s)-2-chloro-3-(3-chloro-2-methyl-phenyl)propanenitrile
Molecular Mass 214.091 g·mol−1
Heat of Formation 65.3 ± 16.7 kJ·mol−1
Dipole Moment 2.61 ± 1.08 D
Volume 243.49 Å 3
Surface Area 224.8 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-chloro-3-(3-chloro-2-methyl-phenyl)propanenitrile
  • (2s)-2-chloro-3-(3-chloro-2-methyl-phenyl)propionitrile
InChIKey YYJUXSGXHHPBTK-VIFPVBQESA-N
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Elements H C N Cl