2-Bromo-N-[(11As)-7-Methoxy-11A-Methyl-2,3,3A,3B,4,5,9B,10,11,11A-Decahydrophenanthro[2,1-B]Furan-6-Yl]Acetamide

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Properties Simple | Detailed

Formula C20H26BrNO3
IUPAC Name n-[(3as,3br,9br,11as)-7-methoxy-11a-methyl-3,3a,3b,4,5,9b,10,11-octahydro-2h-naphtho[2,1-e]benzofuran-6-yl]-2-bromo-acetamide
Molecular Mass 408.329 g·mol−1
Heat of Formation -505.8 ± 16.7 kJ·mol−1
Dipole Moment 1.04 ± 1.08 D
Volume 432.73 Å 3
Surface Area 354.57 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 2.92 ± eV
Point Group Symmetry C1
InChIKey KAXBPFVTQJMGBD-IDLUEMFASA-N
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Elements H C O Br N