2,5-Bis(1-Aziridinyl)-3,6-Dimethyl-1,4-Benzoquinone

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Properties Simple | Detailed

Formula C12H14N2O2
IUPAC Name 2,5-bis(aziridin-1-yl)-3,6-dimethyl-1,4-benzoquinone
Molecular Mass 218.252 g·mol−1
Heat of Formation 106.8 ± 16.7 kJ·mol−1
Dipole Moment 0.15 ± 1.08 D
Volume 265.2 Å 3
Surface Area 241.09 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy 1.42 ± eV
Point Group Symmetry Ci
Synonyms
  • 2,5-bis(aziridin-1-yl)-3,6-dimethyl-cyclohexa-2,5-diene-1,4-dione
  • 2,5-bis(aziridin-1-yl)-3,6-dimethylcyclohexa-2,5-diene-1,4-dione
  • 2,5-cyclohexadiene-1,4-dione, 2,5-bis(1-aziridinyl)-3,6-dimethyl-
  • 2,5-diethylenimino-3,6-dimethyl-p-benzoquinone
  • 2,5-dimethyl-3,6-diaziridinyl-1,4-benzoquinone
  • medzq
  • neuro_000349
CAS Number(s)
  • 18735-47-2
InChIKey IWVCOLOPRNYONP-UHFFFAOYSA-N
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