(6R,7S,10R,11R,12Z,17Z,19Z,21S)-6-{[2-(Diethylamino)Ethyl]Sulfonyl}-21-Hydroxy-10-Isopropyl-11,19-Dimethyl-9,26-Dioxa-3,15,28-Triazatricyclo[23.2.1.0~3,7~]Octacosa-1(27),12,17,19,25(28)-Pentaene-2,8,14,23-Tetrone

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Properties Simple | Detailed

Formula C34H50N4O9S
IUPAC Name [2-[3-[2-(diethynylamino)ethynylsulfonyl]-1-(2,5-dihydrooxazole-4-carbonyl)pyrrolidin-2-yl]-6-prop-1-ynyl-4h-1,3-dioxin-5-yl]methyl-hydroxy-ammonium; molecular oxygen
Molecular Mass 690.847 g·mol−1
Heat of Formation -1454.3 ± 16.7 kJ·mol−1
Dipole Moment 7.07 ± 1.08 D
Volume 842.2 Å 3
Surface Area 607.03 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -0.69 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(2-diethylamino-ethanesulfonyl)-21-hydroxy-10-isopropyl-11,19-dimethyl-9,26-dioxa-3,15,28-triaza-tricyclo[23.2.1.00,255]octacosa-1(27),12,17,19,25(28)-pentaene-2,8,14,23-tetraone
  • dol
InChIKey SUYRLXYYZQTJHF-SSBZBSMWSA-N
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