6-Phenyl-N-(4-Pyridinyl)Pyrrolo[2,1-F][1,2,4]Triazin-4-Amine

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Properties Simple | Detailed

Formula C17H13N5
IUPAC Name 6-phenyl-n-pyridin-4-ylpyrrolo[2,1-f][1,2,4]triazin-4-amine
Molecular Mass 287.319 g·mol−1
Heat of Formation 590.4 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 332.38 Å 3
Surface Area 310.14 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy 0.81 ± eV
Point Group Symmetry C1
InChIKey KOECVTWSFPGZJE-UHFFFAOYSA-N
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Elements H C N