Crystallography Open Database

Information card for entry 4075460

Preview

Coordinates	4075460.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H86 N4 P2 S4
Calculated formula	C74 H81 N4 P2 S4
Title of publication	Phosphole-Containing Hybrid Calixpyrroles: New Multifunctional Macrocyclic Ligands for Platinum(II) Ions
Authors of publication	Matano, Yoshihiro; Nakabuchi, Takashi; Miyajima, Tooru; Imahori, Hiroshi
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	13
Pages of publication	3105
a	12.9517 ± 0.0019 Å
b	12.9645 ± 0.0019 Å
c	20.395 ± 0.003 Å
α	82.092 ± 0.004°
β	83.09 ± 0.004°
γ	86.68 ± 0.004°
Cell volume	3364.4 ± 0.9 Å³
Cell temperature	123.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0493
Weighted residual factors for all reflections included in the refinement	0.1329
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4075460.html