7-Bromo-2-(4-Pyridinyl)Thieno[3,2-C]Pyridin-4(5H)-One

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Properties Simple | Detailed

Formula C12H7BrN2OS+
IUPAC Name 7-bromo-2-(4-pyridyl)thieno[3,2-c]pyridine-1,5-diium-4-one
Molecular Mass 307.166 g·mol−1
Heat of Formation 139.3 ± 16.7 kJ·mol−1
Dipole Moment 4.46 ± 1.08 D
Volume 278.52 Å 3
Surface Area 258.63 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -1.90 ± eV
Point Group Symmetry Cs
InChIKey YFBJHINTWOTPAK-UHFFFAOYSA-N
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Elements C H O N S Br