(4S,4As,5As,6S,12As)-7-Chloro-4-(Dimethylamino)-3,6,10,11,12A-Pentahydroxy-1,12-Dioxo-4A,5,5A,6-Tetrahydro-4H-Tetracene-2-Carboxamide

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Formula C21H19ClN2O8
IUPAC Name (5s,5as,6as,7s,10as)-4-chloro-7-(dimethylamino)-5,8,10a,12-tetrahydroxy-9-(oxaziren-3-yl)-2,5,5a,6,6a,7-hexahydrotetracene-2,4-diide-1,10,11-trione
Molecular Mass 462.837 g·mol−1
Heat of Formation -343.4 ± 16.7 kJ·mol−1
Dipole Moment 11.30 ± 1.08 D
Volume 475.6 Å 3
Surface Area 382.1 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy -3.03 ± eV
Point Group Symmetry C1
InChIKey HACVRJQARVMPPW-SEYHBJAFSA-N
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Elements H C N O Cl