Formula |
C27H30N4O7S |
IUPAC Name |
(1s)-1-[3-[[2-(3-methoxy-n-[2-(n-methylanilino)-2-oxo-ethyl]anilino)-2-oxo-ethyl]carbamoylamino]phenyl]ethanesulfonic acid |
Molecular Mass |
554.615 g·mol−1 |
Heat of Formation |
-932.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.05 ± 1.08 D |
Volume |
636.56 Å 3 |
Surface Area |
527.0 Å 2 |
HOMO Energy |
-8.90 ± 0.55 eV |
LUMO Energy |
-0.23 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
GNUWAISTUMNFFJ-IBGZPJMESA-N |
QR Code |
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Links |
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Elements |
H
S
C
O
N
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