9-Chloro-5-(4-Hydroxyphenyl)-8-Methoxy-2,3,4,5-Tetrahydro-1H-3-Benzazepin-7-Ol

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Properties Simple | Detailed

Formula C17H18ClNO3
IUPAC Name (1r)-6-chloro-1-(4-hydroxyphenyl)-7-methoxy-2,3,4,5-tetrahydro-1h-3-benzazepin-8-ol
Molecular Mass 319.783 g·mol−1
Heat of Formation -377.9 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 361.97 Å 3
Surface Area 313.87 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
InChIKey UEWJZXRBBYETAL-CQSZACIVSA-N
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Elements H C N O Cl