(6Z)-13-Chloro-14,16-Dihydroxy-2-Methyl-3,4,5,8,9,10-Hexahydro-2-Benzazacyclotetradecine-1,11(2H,12H)-Dione

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Properties Simple | Detailed

Formula C18H22ClNO4
IUPAC Name (7z)-18-chloro-15,17-dihydroxy-12-methyl-12-azabicyclo[12.4.0]octadeca-1(18),7,14,16-tetraene-3,13-dione
Molecular Mass 351.825 g·mol−1
Heat of Formation -697.2 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 406.58 Å 3
Surface Area 324.51 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy 2.29 ± eV
Point Group Symmetry C1
InChIKey XARNDFBZFLICCU-IHWYPQMZSA-N
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Elements H C N O Cl