N,N-Diethyl-N'-(1-Ethyl-6-Methylergolin-8-Yl)Sulfuric Diamide

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Formula C21H31N4O2ST
IUPAC Name (6ar,9s,10as)-9-(diethylsulfamoylamino)-4-ethyl-7-(tritiomethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline
Molecular Mass 406.577 g·mol−1
Heat of Formation -251.2 ± 16.7 kJ·mol−1
Dipole Moment 6.09 ± 1.08 D
Volume 494.34 Å 3
Surface Area 412.54 Å 2
HOMO Energy -8.13 ± 0.55 eV
LUMO Energy 0.11 ± eV
Point Group Symmetry C1
InChIKey ARTRTLXKTHJPRW-XKGZKEIXSA-N
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