6-{[(5-Cyano-2-Pyrazinyl)Carbamoyl]Amino}-2-Naphthoic Acid

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Formula C17H11N5O3
IUPAC Name 6-[(5-cyanopyrazin-2-yl)carbamoylamino]naphthalene-2-carboxylic acid
Molecular Mass 333.301 g·mol−1
Heat of Formation -0.3 ± 16.7 kJ·mol−1
Dipole Moment 6.61 ± 1.08 D
Volume 369.65 Å 3
Surface Area 345.97 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy 2.34 ± eV
Point Group Symmetry C1
InChIKey CACMTVGXYAZZNY-UHFFFAOYSA-N
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