7-Chloro-1-(2,3-Dihydro-1-Benzofuran-7-Yl)-8-(Methoxymethoxy)-3-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine

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Properties Simple | Detailed

Formula C21H24ClNO3
IUPAC Name (3s,5s)-8-chloro-5-(2,3-dihydrobenzofuran-7-yl)-7-(methoxymethoxy)-3-methyl-1,2,4,5-tetrahydro-3-benzazepine
Molecular Mass 373.873 g·mol−1
Heat of Formation -350.0 ± 16.7 kJ·mol−1
Dipole Moment 4.95 ± 1.08 D
Volume 443.15 Å 3
Surface Area 354.87 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -0.07 ± eV
Point Group Symmetry C1
InChIKey UVERZULVAXRWSS-GOSISDBHSA-N
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Elements H C N O Cl