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

Molecule SVG Image

Properties Simple | Detailed

Formula C10H8F2N2O2
IUPAC Name 2,5-bis(aziridin-1-yl)-3,6-difluoro-1,4-benzoquinone
Molecular Mass 226.180 g·mol−1
Heat of Formation -171.3 ± 16.7 kJ·mol−1
Dipole Moment 2.99 ± 1.08 D
Volume 242.04 Å 3
Surface Area 226.24 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy 0.91 ± eV
Point Group Symmetry C2
Synonyms
  • 2,5-bis(1-aziridinyl)-3,6-difluoro-1,4-benzoquinone
  • 2,5-bis(1-aziridinyl)-3,6-difluoro-2,5-cyclohexadiene-1,4-dione
  • 2,5-bis(aziridin-1-yl)-3,6-difluoro-cyclohexa-2,5-diene-1,4-dione
  • 2,5-bis(aziridin-1-yl)-3,6-difluorocyclohexa-2,5-diene-1,4-dione
  • 2,5-cyclohexadiene-1,4-dione, 2,5-bis(1-aziridinyl)-3,6-difluoro-
  • 2,5-diethylenimino-3,6-difluoro-p-benzoquinone
  • tw19
CAS Number(s)
  • 2341-31-3
InChIKey SXHRKCIELHYDFG-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F