Formula |
C20H16N4O5S |
IUPAC Name |
3-hydroxy-7-[(4s)-3-methyl-5-oxo-4-[(e)-phenylazo]-4h-pyrazol-1-yl]naphthalene-1-sulfonic acid |
Molecular Mass |
424.430 g·mol−1 |
Heat of Formation |
-232.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.61 ± 1.08 D |
Volume |
454.45 Å 3 |
Surface Area |
404.92 Å 2 |
HOMO Energy |
-8.74 ± 0.55 eV |
LUMO Energy |
-1.37 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
JKSAMORUXOGBSQ-XJUMHSELSA-N |
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Links |
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Elements |
H
S
C
O
N
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