Formula |
C27H31N5O5S |
IUPAC Name |
2-[(7-carbamimidoyl-2-naphthyl)methyl-[4-[(1-ethanimidoyl-4-piperidyl)oxy]phenyl]sulfamoyl]acetic acid |
Molecular Mass |
537.631 g·mol−1 |
Heat of Formation |
-515.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.76 ± 1.08 D |
Volume |
629.03 Å 3 |
Surface Area |
510.47 Å 2 |
HOMO Energy |
-8.96 ± 0.55 eV |
LUMO Energy |
-1.18 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NPBKHEMDWREFJJ-VEILYXNESA-N |
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Elements |
H
C
S
O
N
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