5-[(2Z)-2-{2-Anilino-1-[(E)-(2-Methoxy-4-Nitro-5-Sulfophenyl)Diazenyl]-2-Oxoethylidene}Hydrazino]-4-Methoxy-2-Nitrobenzenesulfonic Acid

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Properties Simple | Detailed

Formula C22H25N7O13S2
IUPAC Name [(e)-[2-anilino-1-(2-methoxy-4-nitro-5-sulfo-anilino)azanidyl-2-oxo-ethylidene]amino]-(2-methoxy-4-nitro-5-sulfo-phenyl)azanide
Molecular Mass 659.603 g·mol−1
Heat of Formation -841.1 ± 16.7 kJ·mol−1
Dipole Moment 3.13 ± 1.08 D
Volume 656.41 Å 3
Surface Area 568.78 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -2.29 ± eV
Point Group Symmetry C1
InChIKey SDLXZYXLQUWDNF-IEBJKEOESA-N
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