6-(5-Bromo-2-Hydroxyphenyl)-2-Oxo-4-Phenyl-1,2-Dihydro-3-Pyridinecarbonitrile

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Properties Simple | Detailed

Formula C18H11BrN2O2+
IUPAC Name 6-(5-bromo-2-hydroxy-phenyl)-2-oxo-4-phenyl-pyridin-1-ium-3-ide-3-carbonitrile
Molecular Mass 367.196 g·mol−1
Heat of Formation 66.5 ± 16.7 kJ·mol−1
Dipole Moment 6.69 ± 1.08 D
Volume 370.69 Å 3
Surface Area 330.71 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 1.56 ± eV
Point Group Symmetry C1
InChIKey SVSYJTYGPLVUOZ-UHFFFAOYSA-O
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Elements H C Br O N