4-(Carbamoylamino)-1-(7-Isopropoxy-1-Naphthyl)-1H-Pyrazole-3-Carboxamide

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Properties Simple | Detailed

Formula C18H19N5O3
IUPAC Name 1-(7-isopropoxy-1-naphthyl)-4-ureido-pyrazol-1-ium-2-ide-3-carboxamide
Molecular Mass 353.375 g·mol−1
Heat of Formation -215.5 ± 16.7 kJ·mol−1
Dipole Moment 4.83 ± 1.08 D
Volume 405.46 Å 3
Surface Area 369.27 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
InChIKey GYKHVLWAQGEZTM-UHFFFAOYSA-N
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