(3S,5S)-5-(2,3-Dihydrobenzofuran-7-Yl)-3-Methyl-8-Nitro-1,2,4,5-Tetrahydro-3-Benzazepin-7-Ol

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Formula C19H20N2O4
IUPAC Name (3s,5s)-5-(2,3-dihydrobenzofuran-7-yl)-3-methyl-8-nitro-1,2,4,5-tetrahydro-3-benzazepin-7-ol
Molecular Mass 340.373 g·mol−1
Heat of Formation -206.8 ± 16.7 kJ·mol−1
Dipole Moment 5.63 ± 1.08 D
Volume 391.42 Å 3
Surface Area 338.67 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 2.94 ± eV
Point Group Symmetry C1
InChIKey MYMXZBOAHRRFGF-MRXNPFEDSA-N
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