(6R,7R)-6-(4-Methoxyphenyl)-6,7-Dihydropyrrolo[2,1-D][1,5]Benzothiazepin-7-Ol

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Formula C19H17NO2S
IUPAC Name (6r,7r)-6-(4-methoxyphenyl)-6,7-dihydropyrrolo[2,1-d][1,5]benzothiazepin-7-ol
Molecular Mass 323.409 g·mol−1
Heat of Formation -7.2 ± 16.7 kJ·mol−1
Dipole Moment 1.56 ± 1.08 D
Volume 372.65 Å 3
Surface Area 320.07 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
InChIKey BGBGSDYFNXHIKG-MOPGFXCFSA-N
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