(9R)-7-[3,5-Bis(Trifluoromethyl)Benzyl]-9-Methyl-5-(4-Methylphenyl)-8,9,10,11-Tetrahydro-7H-[1,4]Diazocino[2,1-G][1,7]Naphthyridine-6,13-Dione

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Formula C30H25F6N3O2
IUPAC Name (9r)-7-[[3,5-bis(trifluoromethyl)phenyl]methyl]-9-methyl-5-(p-tolyl)-8,9,10,11-tetrahydro-[1,4]diazocino[2,1-g][1,7]naphthyridine-6,13-dione
Molecular Mass 573.529 g·mol−1
Heat of Formation -1364.1 ± 16.7 kJ·mol−1
Dipole Moment 1.76 ± 1.08 D
Volume 633.76 Å 3
Surface Area 467.81 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy -1.41 ± eV
Point Group Symmetry C1
InChIKey LDXQLWNPGRANTO-GOSISDBHSA-N
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