3-Methyl-6-(3-(3-(Trifluoromethyl)Phenyl)-1-Pyrrolidinyl)Pyridazine

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Properties Simple | Detailed

Formula C16H16F3N3
IUPAC Name 3-methyl-6-[(1s,3r)-3-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]pyridazine
Molecular Mass 307.314 g·mol−1
Heat of Formation -394.8 ± 16.7 kJ·mol−1
Dipole Moment 6.21 ± 1.08 D
Volume 346.28 Å 3
Surface Area 315.6 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry C1
InChIKey KTOOXVVTDOFPMM-ZDUSSCGKSA-N
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Elements H C N F