[6-[(E)-2-(5-Nitro-2-Furyl)Vinyl]-3H-Pyridin-1-Ium-3-Id-2-Yl]Methanol

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Properties Simple | Detailed

Formula C12H11N2O4
IUPAC Name [6-[(e)-2-(5-nitro-2-furyl)vinyl]-3h-pyridin-1-ium-3-id-2-yl]methanol
Molecular Mass 247.227 g·mol−1
Heat of Formation -25.7 ± 16.7 kJ·mol−1
Dipole Moment 4.11 ± 1.08 D
Volume 276.91 Å 3
Surface Area 271.4 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy 1.24 ± eV
Point Group Symmetry C1
InChIKey JVCAZNDRHAERCS-SNAWJCMRSA-N
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