5-Methyl-6-Nitrochrysene

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Properties Simple | Detailed

Formula C19H13NO2
IUPAC Name 5-methyl-6-nitro-chrysene
Molecular Mass 287.312 g·mol−1
Heat of Formation 272.0 ± 16.7 kJ·mol−1
Dipole Moment 5.05 ± 1.08 D
Volume 325.16 Å 3
Surface Area 287.93 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -1.53 ± eV
Point Group Symmetry C1
Synonyms
  • 6-nitro-5-methylchrysene
CAS Number(s)
  • 105802-11-7
InChIKey BRHWSCIEJDCELY-UHFFFAOYSA-N
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