2-[2-(2-{4-[(α-D-Glucopyranosyloxy)Methyl]-1H-1,2,3-Triazol-1-Yl}Ethoxy)Ethoxy]Ethyl 2-[3,6-Bis(Diethylamino)-9H-Xanthen-9-Yl]Benzoate

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Properties Simple | Detailed

Formula C43H57N5O11
IUPAC Name 2-[2-(2-{4-[(alpha-d-glucopyranosyloxy)methyl]-1h-1,2,3-triazol-1-yl}ethoxy)ethoxy]ethyl 2-[3,6-bis(diethylamino)-9h-xanthen-9-yl]benzoate
Molecular Mass 819.940 g·mol−1
Heat of Formation -1521.2 ± 16.7 kJ·mol−1
Dipole Moment 6.41 ± 1.08 D
Volume 986.91 Å 3
Surface Area 825.61 Å 2
HOMO Energy -7.83 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
InChIKey LPSYXQPVOZLKRL-OUZFDYGBSA-N
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