2,2'-{[2-(2-{2-[(Carboxylatomethyl)Amino]-5-(2,7-Difluoro-6-Oxido-3-Oxo-8A,10A-Dihydro-3H-Xanthen-9-Yl)Phenoxy}Ethoxy)-4-Methoxyphenyl]Imino}Diacetate

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Properties Simple | Detailed

Formula C34H49F2N2O12
IUPAC Name (e)-carboxymethylene-[4-[(e)-(3-fluoro-4,6-dioxo-cyclohex-2-en-1-ylidene)methyl]-2-hydroxy-phenyl]ammonium; 2-[2,2-dihydroxyvinyl(vinyl)amino]-5-methoxy-cyclohexa-2,4-dien-1-one; ethane; 3-fluorobutan-2-one; hydron; λ1-carbane; dihydroxide
Molecular Mass 716.764 g·mol−1
Heat of Formation -1525.8 ± 16.7 kJ·mol−1
Dipole Moment 36.58 ± 1.08 D
Volume 785.44 Å 3
Surface Area 592.78 Å 2
HOMO Energy -6.71 ± 0.55 eV
LUMO Energy -2.78 ± eV
Point Group Symmetry C1
InChIKey CPNQONUQMRZGPJ-UZTOHYMASA-N
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