2,2-Dimethyl-4-(2-Oxo-1(2H)-Pyridinyl)-2H-Chromene-6-Carbonitrile

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Properties Simple | Detailed

Formula C17H14N2O2+
IUPAC Name 2,2-dimethyl-4-(2-oxo-1-pyridyl)chromene-6-carbonitrile
Molecular Mass 278.305 g·mol−1
Heat of Formation -0.2 ± 16.7 kJ·mol−1
Dipole Moment 4.65 ± 1.08 D
Volume 332.43 Å 3
Surface Area 295.79 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 2,2-dimethyl-4-(2-oxo-1(2h)-pyridyl)-2h-1-benzopyran-6-carbonitrile
  • 2,2-dimethyl-4-(2-oxo-1-pyridyl)-6-chromenecarbonitrile
  • 2,2-dimethyl-4-(2-oxopyridin-1(2h)-yl)-2h-chromene-6-carbonitrile
  • 2,2-dimethyl-4-(2-oxopyridin-1-yl)chromene-6-carbonitrile
  • 2h-1-benzopyran-6-carbonitrile, 2,2-dimethyl-4-(2-oxo-1(2h)-pyridinyl)-
  • 4-(2-keto-1-pyridyl)-2,2-dimethyl-chromene-6-carbonitrile
  • bimakalim
  • emd 52692
  • emd-52692
  • sr-44866
CAS Number(s)
  • 117545-11-6
InChIKey JTVSKASWNROQQF-UHFFFAOYSA-N
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