3-(4-Amino-1,3,5-Triazin-2-Yl)-4-Hydroxybenzonitrile

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Properties Simple | Detailed

Formula C10H7N5O
IUPAC Name 3-(4-amino-1,3,5-triazin-2-yl)-4-hydroxy-benzonitrile
Molecular Mass 213.195 g·mol−1
Heat of Formation 196.7 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 235.47 Å 3
Surface Area 231.2 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy 1.62 ± eV
Point Group Symmetry Cs
InChIKey ATWKNNOBDMPYCY-UHFFFAOYSA-N
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Elements H C O N