Formula |
C18H16N4O9S2 |
IUPAC Name |
2-[(e)-[5-hydroxy-1-(4-hydroxysulfonyl-2-methyl-phenyl)-3-methyl-pyrazol-4-yl]azo]-4-hydroxysulfonyl-benzoic acid |
Molecular Mass |
496.471 g·mol−1 |
Heat of Formation |
-1080.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.53 ± 1.08 D |
Volume |
493.01 Å 3 |
Surface Area |
438.91 Å 2 |
HOMO Energy |
-9.38 ± 0.55 eV |
LUMO Energy |
-1.94 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NOQURKNIKJDEPW-FMQUCBEESA-N |
QR Code |
Generate QR Code |
Links |
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
S
O
N
|
|
|