Tofimilast

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Formula C18H21N5S
IUPAC Name 12-cyclopentyl-10-ethyl-5-(2-thienyl)-3,4,6,11,12-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,10-tetraene
Molecular Mass 339.458 g·mol−1
Heat of Formation 440.0 ± 16.7 kJ·mol−1
Dipole Moment 5.24 ± 1.08 D
Volume 401.05 Å 3
Surface Area 356.15 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
InChIKey DHCOPPHTVOXDKU-UHFFFAOYSA-N
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Elements H S C N