Formula |
C16H15N5O7S2 |
IUPAC Name |
2-[2-[(5-acetamido-1,3,4-thiadiazol-2-yl)sulfonylcarbamoyl]-5-methoxy-indol-1-ium-1-yl]acetic acid |
Molecular Mass |
453.450 g·mol−1 |
Heat of Formation |
-752.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.65 ± 1.08 D |
Volume |
470.5 Å 3 |
Surface Area |
408.98 Å 2 |
HOMO Energy |
-8.50 ± 0.55 eV |
LUMO Energy |
1.50 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
VIHSTBSIMXHLDH-UHFFFAOYSA-N |
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Elements |
H
C
S
O
N
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