Formula |
C34H36N2O18P4S2 |
IUPAC Name |
[1-hydroxy-2-[3-[3-[[3-[[3-[3-(2-hydroxy-2,2-diphosphono-ethyl)phenyl]phenyl]sulfamoyl]phenyl]sulfonylamino]phenyl]phenyl]-1-phosphono-ethyl]phosphonic acid |
Molecular Mass |
948.677 g·mol−1 |
Heat of Formation |
-3672.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.19 ± 1.08 D |
Volume |
983.23 Å 3 |
Surface Area |
704.79 Å 2 |
HOMO Energy |
-8.93 ± 0.55 eV |
LUMO Energy |
-1.14 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UKSQFLAKPJZXNT-UHFFFAOYSA-N |
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Elements |
C
H
O
N
P
S
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