Crystallography Open Database

Information card for entry 4500312

Preview

Coordinates	4500312.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H34 Cd N7 O9 P
Calculated formula	C21 H34 Cd N7 O9 P
Title of publication	Carbophosphazene-Based Multisite Coordination Ligands: Metalation Studies on the Pyridyloxy Carbophosphazene, [NC(NMe2)]2[NP(p-OC5H4N)2]
Authors of publication	Chandrasekhar, Vadapalli; Senapati, Tapas; Dey, Atanu; Hossain, Sakiat; Gopal, Kandasamy
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	5
Pages of publication	1512
a	26.154 ± 0.005 Å
b	15.106 ± 0.005 Å
c	16.753 ± 0.005 Å
α	90 ± 0.005°
β	118.632 ± 0.005°
γ	90 ± 0.005°
Cell volume	5809 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0434
Residual factor for significantly intense reflections	0.0373
Weighted residual factors for significantly intense reflections	0.0956
Weighted residual factors for all reflections included in the refinement	0.0997
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179534 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/03.	4500312.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500312.cif
34443	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500312, 4500313, 4500314, 4500315, 4500316, 4500317 via cif-deposit CGI script.	4500312.cif