Compound | I | II | IIIa | IIIb | IV |
---|---|---|---|---|---|
Formula | C23H16N2O2 | C25H18N2O2 | C27H20N2O2 | C27H20N2O2 | C28H22N2O2 |
F. Wt. | 352.38 | 378.41 | 404.45 | 404.45 | 418.48 |
Space group | P21 | P21/n | P21/c | C2/c | P21/c |
a (Å) | 10.352(1) | 14.384 | 10.07(3) | 20.349(2) | 8.610(4) |
b (Å) | 7.212(1) | 8.214 | 23.91(5) | 10.095(2) | 12.780(5) |
c (Å) | 13.320(1) | 17.365 | 9.50(5) | 21.338(2) | 20.458(8) |
α (deg) | 90 | 90 | 90 | 90 | 90 |
β(deg) | 110.33(1) | 105.53(1) | 110.4(2) | 99.06(2) | 101.72(3) |
γ (deg) | 90 | 90 | 90 | 90 | 90 |
Z/Z’ | 2/1 | 4/1 | 4/1 | 8/1 | 4/1 |
V (Å3) | 932.49 | 1976.7(2) | 2144(13) | 4328.6(10) | 2204.19(16) |
R/Rw | 0.043/0.126 | 0.041/0.114 | 0.089/0.207 | 0.062/0.159 | 0.043/0.084 |
CCDC Dep/Ref code | 1009944 | 1009945 | DOQNAY01 | DOQNAY | 1009946 |