Formula |
C33H29F3N4O4S |
IUPAC Name |
6-[5-[(z)-(2,4-dioxothiazolidin-5-ylidene)methyl]-2-furyl]-n-[3-[(4-ethylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl]naphthalene-1-carboxamide |
Molecular Mass |
634.668 g·mol−1 |
Heat of Formation |
-837.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.09 ± 1.08 D |
Volume |
710.62 Å 3 |
Surface Area |
604.28 Å 2 |
HOMO Energy |
-8.88 ± 0.55 eV |
LUMO Energy |
-1.85 ± eV |
Point Group Symmetry |
C1
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InChIKey |
QFKROKXEJOKXGQ-MIXAMLLLSA-N |
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Elements |
C
F
H
O
N
S
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