Formula |
C18H15FN6O2S |
IUPAC Name |
(5z)-5-[(5-ethyl-2-furyl)methylene]-2-[[(s)-(4-fluorophenyl)-(2h-tetrazol-5-yl)methyl]amino]thiazol-4-one |
Molecular Mass |
398.414 g·mol−1 |
Heat of Formation |
165.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.71 ± 1.08 D |
Volume |
441.5 Å 3 |
Surface Area |
395.77 Å 2 |
HOMO Energy |
-8.87 ± 0.55 eV |
LUMO Energy |
-1.34 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
BKZOQCGDCHOGOQ-MZLJFPOFSA-N |
QR Code |
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Elements |
C
F
H
O
N
S
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