1-fluoroheptane
1-fluoroheptane structure
|
Common Name | 1-fluoroheptane | ||
|---|---|---|---|---|
| CAS Number | 661-11-0 | Molecular Weight | 118.19200 | |
| Density | 0.806 g/mL at 25 °C(lit.) | Boiling Point | 119.2 °C750 mm Hg(lit.) | |
| Molecular Formula | C7H15F | Melting Point | -73°C | |
| MSDS | Chinese USA | Flash Point | 57 °F | |
| Symbol |
GHS02, GHS07 |
Signal Word | Danger | |
|
Localized optimized orbitals, coupled cluster theory, and chiroptical response properties.
Phys. Chem. Chem. Phys. 14(21) , 7830-6, (2012) The impact of orbital localization on the efficiency and accuracy of the optimized-orbital coupled cluster model is examined for the prediction of chiroptical properties, in particular optical rotation. The specific rotations of several test cases-(P)-[4]tria... |
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