Crystallography Open Database





Information card for 1000004

1000003 << 1000004 >> 1000005

Preview



Coordinates

1000004.cif

Structure parameters

Formula - C29 H30 Cu I P2 -
Calculated formula - C29 H30 Cu I P2 -
a 9.899 ± 0.005 Å
b 11.729 ± 0.005 Å
c 12.259 ± 0.005 Å
α 103.442 ± 0.005°
β 96.291 ± 0.005°
γ 95.56 ± 0.005°
Cell volume 1364.9 ± 1.1 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 5
Hermann-Mauguin symmetry space group P -1
Residual factor for all reflections 0.0499
Residual factor for observed reflections 0.0469
Weighted residual factors for the observed reflections 0.132
Weighted residual factors for all reflections included in the refinement 0.1372
Goodness-of-fit parameter for observed reflections 1.16
Diffraction radiation wavelength 0.7107 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

Top of the page