4-[(5R)-5-[3-Chloro-5-(Trifluoromethyl)Phenyl]-5-(Trifluoromethyl)-4,5-Dihydro-1,2-Oxazol-3-Yl]-N-{2-Oxo-2-[(2,2,2-Trifluoroethyl)Amino]Ethyl}-1-Naphthamide

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Properties Simple | Detailed

Formula C26H17ClF9N3O3
IUPAC Name 4-[(5r)-5-[3-chloro-5-(trifluoromethyl)phenyl]-5-(trifluoromethyl)-4h-isoxazol-3-yl]-n-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]naphthalene-1-carboxamide
Molecular Mass 625.870 g·mol−1
Heat of Formation -2116.0 ± 16.7 kJ·mol−1
Dipole Moment 4.84 ± 1.08 D
Volume 625.06 Å 3
Surface Area 505.27 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 1.44 ± eV
Point Group Symmetry C1
InChIKey OXDDDHGGRFRLEE-HSZRJFAPSA-N
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Elements C F H Cl O N