1-(Trans-4-Hexylcyclohexyl)-4-Isothiocyanatobenzene

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Properties Simple | Detailed

Formula C19H27NS
IUPAC Name 1-(4-hexylcyclohexyl)-4-isothiocyanato-benzene
Molecular Mass 301.489 g·mol−1
Heat of Formation 15.6 ± 16.7 kJ·mol−1
Dipole Moment 4.97 ± 1.08 D
Volume 403.38 Å 3
Surface Area 374.73 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy 2.06 ± eV
Point Group Symmetry C1
InChIKey STLICVZWECVJDT-QAQDUYKDSA-N
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Elements H S C N