Table 1 Normalized unit cell parameters of 1 in three phases based on the ITP
LTP-173K | ITP-253K | HTP-333K | |
|---|---|---|---|
a/Å | 9.0775(2) | 9.8984(9) | 9.2432(5) |
b/Å | 15.8322(3) | 15.0923(10) | 16.0097(9) |
c/Å | 8.1501(3) | 8.0597(5) | 8.1797(4) |
α/° | 84.399(2) | 90 | 90 |
β/° | 92.354(2) | 97.887(7) | 90 |
γ/° | 83.8690(10) | 90 | 90 |
V/Å3 | 1158.49(5) | 1192.65(15) | 1210.44(7) |