2-(2-Methoxy-4-Nitro-5-Sulfonato-Phenyl)-3-(2-Methoxy-4-Nitro-5-Sulfo-Phenyl)-N-Phenyl-Blahcyclopenta-4,5-Diene-5-Carboxamide

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Properties Simple | Detailed

Formula C22H22N7O13S2
IUPAC Name 2-(2-methoxy-4-nitro-5-sulfonato-phenyl)-3-(2-methoxy-4-nitro-5-sulfo-phenyl)-n-phenyl-blahcyclopenta-4,5-diene-5-carboxamide
Molecular Mass 656.579 g·mol−1
Heat of Formation -603.1 ± 16.7 kJ·mol−1
Dipole Moment 19.30 ± 1.08 D
Volume 632.33 Å 3
Surface Area 491.76 Å 2
HOMO Energy -9.91 ± 0.55 eV
LUMO Energy -3.10 ± eV
Point Group Symmetry C1
InChIKey UQKKKMHHSRFECA-UHFFFAOYSA-N
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